SCHEMBL30503896

SCHEMBL30503896

N[C@H]1C=C(C(=O)O)C[C@H]1C(F)F

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABAT P80404 1/20 0.43
▸ GABRR1 P24046 1/20 0.40
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ OAT P04181 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ THRB P10828 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ PMP22 Q01453 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
Hydrochloric Acid SCHEMBL25404022 0.98 ABAT (0.42) ABATGABRR1TSHRMAPK1HSD17B10
SCHEMBL23706926 0.75 ABAT (0.47) ABATGABRR1TSHRMAPK1HSD17B10
Hydrochloric Acid SCHEMBL25403649 0.74 ABAT (0.43) ABATGABRR1TSHRMAPK1HSD17B10
Hydrochloric Acid SCHEMBL23699861 0.73 ABAT (0.46) ABATGABRR1TSHRMAPK1HSD17B10
SCHEMBL23706934 0.71 GABRR1 (0.44) ABATGABRR1TSHRMAPK1HSD17B10
SCHEMBL23706930 0.71 ABAT (0.47) ABATGABRR1TSHRMAPK1HSD17B10
Hydrochloric Acid SCHEMBL23699851 0.69 THRB (0.43) ABATGABRR1TSHRMAPK1HSD17B10
Hydrochloric Acid SCHEMBL23699848 0.69 ABAT (0.46) ABATGABRR1TSHRMAPK1HSD17B10
SCHEMBL4315702 0.69 GABRR1 (0.42) ABATGABRR1TSHRMAPK1HSD17B10
Hydrochloric Acid SCHEMBL25404353 0.69 ABAT (0.42) ABATGABRR1TSHRMAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4482478-A4 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE UNIV NORTHWESTERN (US) 2026-03-04 — — EP disclosed
US-20250171397-A1 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE UNIV NORTHWESTERN (US) 2025-05-29 — — US disclosed
EP-4482478-A2 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE Northwestern University (US) 2025-01-01 — — EP disclosed
EP-4482478-A2 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE Northwestern University (US) 2025-01-01 — — EP disclosed
WO-2024196853-A1 SUBSTITUTED CYCLOHEXENE AND CYCLOHEXANE INHIBITORS OF ORNITHINE AMINOTRANSFERASE NORTHWESTERN UNIVERSITY (US) 2024-09-26 — — WO disclosed
WO-2023164715-A3 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE NORTHWESTERN UNIVERSITY (US) 2023-10-05 — — WO disclosed
WO-2023164715-A2 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE NORTHWESTERN UNIVERSITY (US) 2023-08-31 — — WO disclosed
WO-2023164715-A2 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE NORTHWESTERN UNIVERSITY (US) 2023-08-31 — — 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 (1 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-20250171397-A1 (3S,4R)-3-AMINO-4-(DIFLUOROMETHYL)CYCLOPENT-1-ENE-1-CARBOXYLIC ACID AND RELATED COMPOUNDS AS SELECTIVE INACTIVATORS OF ORNITHINE AMINOTRANSFERASE DLAT, HHAT, OAT ABAT 6/4885GABRR1 2226/4885TSHR 1835/4885

“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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