SCHEMBL25073035

SCHEMBL25073035

O=S(=O)(Nc1ccc(Br)cc1C(F)F)c1cnc(-c2ccc(F)cc2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.40
▸ PIK3CA P42336 6/20 0.35
▸ MTOR P42345 5/20 0.35
▸ CNR1 P21554 2/20 0.34
▸ LMNA P02545 2/20 0.33
▸ PRNP P04156 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ XDH P47989 1/20 0.33
▸ AKT1 P31749 2/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ CA5B Q9Y2D0 1/20 0.33
▸ VSIR Q9H7M9 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL25734411 0.85 PTPN11 (0.40) THRBLMNAPTPN11KDM4ENPC1
SCHEMBL25734836 0.80 LMNA (0.40) CNR1LMNAPRNPRXFP1VSIR
SCHEMBL25073052 0.76 APP (0.40) THRBPIK3CAMTORLMNAPTPN11
SCHEMBL25073309 0.74 THRB (0.43) THRBLMNAPTPN11NPSR1
SCHEMBL25072760 0.73 KDM4E (0.47) PTPN11KDM4ENPC1ALDH1A1MAPT
SCHEMBL25073315 0.73 KMT2A (0.49) LMNAPTPN11KDM4ENPC1ALDH1A1
SCHEMBL25072774 0.72 METAP2 (0.40) PTPN11KDM4ENPSR1
SCHEMBL25073359 0.72 L3MBTL1 (0.43) LMNAPTPN11KDM4ENPC1ALDH1A1
SCHEMBL25073084 0.72 GUSB (0.44) LMNAKDM4ENPC1ALDH1A1CYP3A4
SCHEMBL25734249 0.72 MAPT (0.42) LMNAKDM4ENPC1ALDH1A1MAPT

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 THRB 1238/4885PIK3CA 1528/4885MTOR 1374/4885

“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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