SCHEMBL20487891

SCHEMBL20487891

C=CCCCOC(=O)Nc1ccc2c(C(C)=O)nn(CC(=O)OC(C)(C)C)c2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.35
▸ RAB9A P51151 5/20 0.35
▸ LMNA P02545 1/20 0.35
▸ BRD4 O60885 2/20 0.33
▸ NPC1 O15118 4/20 0.33
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ CFD P00746 2/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C9 P11712 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ ACSS2 Q9NR19 1/20 0.32
▸ EPHX2 P34913 1/20 0.32
▸ CA12 O43570 1/20 0.31

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
SCHEMBL29854881 0.97 HPGD (0.34) HPGDRAB9ALMNABRD4NPC1
SCHEMBL20488749 0.88 RAB9A (0.38) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL20488757 0.86 QPCT (0.39) BRD4CFD
SCHEMBL20488754 0.86 HPGD (0.37) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL25965640 0.86 RAB9A (0.37) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL23589763 0.80 RAB9A (0.38) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL29855032 0.79 DYRK1A (0.37) BRD4CFDACHE
SCHEMBL29854911 0.79 DGAT2 (0.41) HPGDBRD4SMN1; SMN2ALDH1A1KDM4E
SCHEMBL20488336 0.79 DGAT2 (0.41) HPGDBRD4SMN1; SMN2ALDH1A1KDM4E
SCHEMBL26137040 0.75 GAA (0.40) CFDTRPV1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12297205-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2025-05-13 — — US disclosed
US-20240059702-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2024-02-22 — — US disclosed
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 — — US disclosed
EP-3589287-B1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2022-09-14 — — EP disclosed
US-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2021-09-30 — — US disclosed
US-11053253-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2021-07-06 — — US disclosed
WO-2018160892-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-09-07 — — WO 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 (5 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-11718626-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH HPGD 115/4885RAB9A 2435/4885LMNA 1759/4885
US-11053253-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH HPGD 115/4885RAB9A 2435/4885LMNA 1759/4885
US-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH HPGD 115/4885RAB9A 2435/4885LMNA 1759/4885
US-12297205-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH HPGD 115/4885RAB9A 2435/4885LMNA 1759/4885
US-20240059702-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH HPGD 115/4885RAB9A 2435/4885LMNA 1759/4885

“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.

Send feedback