SCHEMBL25073147

SCHEMBL25073147

COc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACLY P53396 12/20 0.66
POLB P06746 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
HPGD P15428 1/20 0.58
KMT2A Q03164 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
RAD52 P43351 1/20 0.57
LIMK2 P53671 1/20 0.52

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
SCHEMBL25072986 0.90 KDM4E (0.63) ACLYPOLBKDM4EALDH1A1LMNA
SCHEMBL25073139 0.90 ACLY (0.73) ACLYKDM4EALDH1A1LMNAMAPT
SCHEMBL25734189 0.87 GAA (0.58) POLBKDM4EALDH1A1LMNAMAPT
SCHEMBL25072656 0.86 POLB (0.60) POLBALDH1A1LMNARAD52
SCHEMBL25072952 0.85 ACLY (0.67) ACLYKDM4EALDH1A1LMNAMAPT
SCHEMBL25073310 0.84 KMT2A (0.59) ACLYPOLBALDH1A1LMNAMAPT
SCHEMBL25734407 0.84 MEN1 (0.59) ACLYPOLBKDM4EALDH1A1LMNA
SCHEMBL1138924 0.83 CYP2C9 (0.63) ACLYPOLBKDM4EALDH1A1LMNA
SCHEMBL25072535 0.83 ACLY (0.56) ACLYALDH1A1LMNATDP1RAD52
SCHEMBL8711266 0.83 POLB (0.78) POLBALDH1A1KMT2ARAD52LIMK2

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 421/4885POLB 1547/4885KDM4E 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.