SCHEMBL25072809

SCHEMBL25072809

COc1cc(C(=O)N(C)O)ccc1NS(=O)(=O)c1cnc(-c2ccc(F)cc2)s1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MEN1 O00255 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ LRRK2 Q5S007 1/20 0.37
▸ BTK Q06187 1/20 0.37
▸ TTK P33981 1/20 0.37
▸ LIMK2 P53671 1/20 0.37
▸ PTPN11 Q06124 1/20 0.37
▸ NAMPT P43490 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ CMA1 P23946 1/20 0.36
▸ NOX1 Q9Y5S8 1/20 0.36
▸ PI4KB Q9UBF8 1/20 0.36
▸ PTK2 Q05397 1/20 0.36

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 0.89 KDM4E (0.46) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25072810 0.88 POLB (0.44) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25072426 0.87 HDAC6 (0.44) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25073055 0.86 KDM4E (0.42) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25073037 0.85 SCN9A (0.50) —
SCHEMBL25073391 0.85 ACLY (0.46) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25073094 0.85 KDM4E (0.43) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25073416 0.85 KDM4E (0.43) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25073084 0.84 GUSB (0.44) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL25734900 0.83 SCN9A (0.41) KDM4EALDH1A1KMT2AMAPTLMNA

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 KDM4E 2637/4885ALDH1A1 125/4885KMT2A 3702/4885

“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