SCHEMBL25737643

SCHEMBL25737643

COc1cc(C(=O)O)c(F)cc1NS(=O)(=O)c1cnc(-c2ccc(-c3ccc(C(F)(F)C(F)(F)F)cc3)cc2)s1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 1/20 0.40
▸ ACLY P53396 8/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ KDM1A O60341 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KIF11 P52732 1/20 0.36
▸ GCK P35557 1/20 0.35
▸ GCKR Q14397 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ USP8 P40818 1/20 0.35
▸ POLQ O75417 1/20 0.35

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
SCHEMBL25734379 0.88 KDM4E (0.51) FABP4ACLYKDM4EALDH1A1LMNA
SCHEMBL25734719 0.88 FABP4 (0.40) FABP4ACLYKDM4EALDH1A1LMNA
SCHEMBL25737555 0.87 ACLY (0.42) FABP4ACLYKDM4EKDM1AALDH1A1
SCHEMBL25737584 0.83 FABP4 (0.40) FABP4ACLYKDM4EKDM1AALDH1A1
SCHEMBL25734681 0.83 ACLY (0.39) FABP4ACLYKDM4EKDM1ALMNA
SCHEMBL25737564 0.83 ACLY (0.39) FABP4ACLYKDM4EKDM1ALMNA
SCHEMBL25737566 0.83 ACLY (0.39) FABP4ACLYKDM4EKDM1ALMNA
SCHEMBL25073564 0.82 FABP4 (0.43) FABP4ACLYKDM4EKMT2A
SCHEMBL25734682 0.82 FABP4 (0.39) FABP4ACLYKDM4EALDH1A1KMT2A
SCHEMBL25737607 0.82 FABP4 (0.40) FABP4ACLYKDM4EKDM1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2023-05-11 — — 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 (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-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF HSD17B1, HSD17B13, HSD17B3 FABP4 781/4885ACLY 421/4885KDM4E 2637/4885

“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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