SCHEMBL25072502

SCHEMBL25072502

COc1cc(C(=O)O)ccc1NS(=O)(=O)c1cnc(-c2ccccc2)s1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 8/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ RAD52 P43351 1/20 0.49
▸ FABP4 P15090 3/20 0.44
▸ LRRK2 Q5S007 1/20 0.43
▸ PTGFR P43088 1/20 0.42
▸ CSNK2A2 P19784 1/20 0.41
▸ CSNK2A1 P68400 1/20 0.41
▸ ERAP2 Q6P179 1/20 0.41
▸ ERAP1 Q9NZ08 1/20 0.41

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
SCHEMBL25073104 0.91 KDM4E (0.46) ACLYTDP1RAD52FABP4LRRK2
SCHEMBL25072736 0.90 ACLY (0.44) ACLYTDP1RAD52FABP4LRRK2
SCHEMBL25073362 0.88 ACLY (0.41) ACLYTDP1RAD52FABP4LRRK2
SCHEMBL25073454 0.88 KIF11 (0.48) ACLYRAD52LRRK2CSNK2A2CSNK2A1
SCHEMBL25073416 0.87 KDM4E (0.43) ACLYTDP1RAD52CSNK2A2CSNK2A1
SCHEMBL25073413 0.86 MEN1 (0.42) ACLYTDP1RAD52LRRK2CSNK2A2
SCHEMBL25737555 0.86 ACLY (0.42) ACLYTDP1RAD52FABP4LRRK2
SCHEMBL25073396 0.85 ACLY (0.43) ACLYTDP1RAD52LRRK2CSNK2A2
SCHEMBL25072551 0.85 ACLY (0.43) ACLYTDP1RAD52LRRK2CSNK2A2
SCHEMBL25734676 0.85 ACLY (0.39) ACLYTDP1RAD52LRRK2CSNK2A2

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 3 patents. 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
US-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2023-05-11 — — US disclosed
WO-2023023310-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. (US) 2023-02-23 — — 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-20230143250-A1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 13 INHIBITORS AND METHODS OF USE THEREOF HSD17B1, HSD17B13, HSD17B3 ACLY 421/4885TDP1 3118/4885RAD52 4005/4885

“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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