SCHEMBL22645702

SCHEMBL22645702

NC1C=C(C(=O)O)CC1=C(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABAT P80404 2/20 1.00
▸ OAT P04181 1/20 0.39
▸ GABRR1 P24046 1/20 0.37
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ THRB P10828 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ PMP22 Q01453 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18717800 1.00 ABAT (1.00) ABATOATGABRR1TSHRMAPK1
Hydrochloric Acid SCHEMBL22645698 0.98 ABAT (0.96) ABATOATGABRR1TSHRMAPK1
Hydrochloric Acid SCHEMBL22645697 0.98 ABAT (0.96) ABATOATGABRR1TSHRMAPK1
SCHEMBL25405315 0.83 ABAT (0.71) ABATOATGABRR1TSHRMAPK1
SCHEMBL29276851 0.83 ABAT (0.71) ABATOATGABRR1TSHRMAPK1
SCHEMBL18717795 0.77 ABAT (0.62) ABATOAT
SCHEMBL22661090 0.75 ABAT (0.59) ABATTSHRHSD17B10KMT2A
Hydrochloric Acid SCHEMBL25434443 0.70 ABAT (0.54) ABATOATGABRR1TSHRMAPK1
Hydrochloric Acid SCHEMBL25434445 0.70 ABAT (0.54) ABATOATGABRR1TSHRMAPK1
SCHEMBL29979297 0.67 ABAT (0.50) ABATOATGABRR1TSHRMAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117550990-A Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2024-02-13 — — CN claimed
CN-117550991-A Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2024-02-13 — — CN claimed
CN-112770739-B Use of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid and related compounds for the treatment of developmental disorders 奥维德医疗公司 2023-12-12 — — CN claimed
CN-112513006-B Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2023-10-31 — — CN claimed
CN-112770739-A Use of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid and related compounds, (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and vigabatrin in the treatment of developmental disorders 奥维德医疗公司 2021-05-07 — — CN claimed
CN-112513006-A Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2021-03-16 — — CN claimed
CN-112261938-A Use of (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid in the treatment of tinnitus, acute sensorineural hearing loss, Meniere 'S disease, Tourette' S syndrome, attention deficit hyperactivity disorder and addiction 奥维德医疗公司 2021-01-22 — — CN claimed
CN-112218628-A Use of (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid in the treatment of ocular disorders 奥维德医疗公司 2021-01-12 — — CN claimed
CN-117550991-B Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2026-01-16 — — CN disclosed
US-12331006-B2 Process for the synthesis of (s) 3-amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid NORTHWESTERN UNIVERSITY (US) 2025-06-17 — — US disclosed
EP-4410773-A2 PROCESS FOR THE SYNTHESIS OF (S) 3-AMINO-4-(DIFLUOROMETHYLENYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID Northwestern University (US) 2024-08-07 — — EP disclosed
EP-3784649-B1 PROCESS FOR THE SYNTHESIS OF (S)-3-AMINO-4-(DIFLUOROMETHYLENYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID UNIV NORTHWESTERN (US) 2024-07-31 — — EP disclosed
CN-117550991-A Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2024-02-13 — — CN disclosed
CN-117550991-A Process for the synthesis of (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid 西北大学 2024-02-13 — — CN disclosed
CN-112261938-A Use of (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid in the treatment of tinnitus, acute sensorineural hearing loss, Meniere 'S disease, Tourette' S syndrome, attention deficit hyperactivity disorder and addiction 奥维德医疗公司 2021-01-22 — — CN disclosed
CN-112218628-A Use of (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid in the treatment of ocular disorders 奥维德医疗公司 2021-01-12 — — CN disclosed
CN-112218628-A Use of (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid in the treatment of ocular disorders 奥维德医疗公司 2021-01-12 — — CN disclosed
CN-112218628-A Use of (1S,3S) -3-amino-4- (difluoromethylene) cyclopentane-1-carboxylic acid and (S) -3-amino-4- (difluoromethylene) cyclopent-1-ene-1-carboxylic acid in the treatment of ocular disorders 奥维德医疗公司 2021-01-12 — — CN disclosed
US-10836708-B2 Process for the synthesis of (s) 3-amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid NORTHWESTERN UNIVERSITY (US) 2020-11-17 — — US disclosed
US-10836708-B2 Process for the synthesis of (s) 3-amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid NORTHWESTERN UNIVERSITY (US) 2020-11-17 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10836708-B2 Process for the synthesis of (s) 3-amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid SULT1E1, QPCT, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ABAT 108/4885OAT 701/4885GABRR1 1179/4885
US-12331006-B2 Process for the synthesis of (s) 3-amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid SULT1E1, QPCT, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ABAT 108/4885OAT 701/4885GABRR1 1179/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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