SCHEMBL24152577

SCHEMBL24152577

O=C1Nc2ccc(S(=O)(=O)NCc3ccc(C(F)(F)F)cc3)cc2/C1=C\c1nccs1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SCN3A Q9NY46 4/20 0.53
▸ SYK P43405 2/20 0.45
▸ SRC P12931 3/20 0.43
▸ NAMPT P43490 2/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ TLK2 Q86UE8 2/20 0.41
▸ MOGAT2 Q3SYC2 1/20 0.39
▸ MGAT2 Q10469 3/20 0.39
▸ NTRK1 P04629 1/20 0.37
▸ CDK2 P24941 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
SCHEMBL24152477 0.89 SYK (0.49) SYKSRCMGAT2CDK2
SCHEMBL24152849 0.88 MGAT2 (0.49) SYKSRCMGAT2NTRK1CDK2
SCHEMBL24151529 0.86 SYK (0.61) SYKSRCTLK2NTRK1
SCHEMBL24152348 0.86 SYK (0.47) SCN3ASYKSRCMGAT2CDK2
SCHEMBL24152858 0.84 NTRK1 (0.46) SYKSRCNAMPTCYP19A1TLK2
SCHEMBL24151508 0.83 IDO1 (0.47) SYKMGAT2
SCHEMBL24151798 0.83 SYK (0.44) SYKSRCNAMPTCYP19A1MGAT2
SCHEMBL24152351 0.82 NTRK1 (0.45) SYKSRCMOGAT2MGAT2NTRK1
SCHEMBL24151530 0.81 SYK (0.48) SYKSRCNTRK1
SCHEMBL24151507 0.81 SYK (0.53) SYKNAMPTCYP19A1TLK2NTRK1

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
WO-2021260722-A1 DESIGN, SYNTHESIS OF NOVEL OXYINDOLE INHIBITORS OF DENV RNA DEPENDENT RNA POLYMERASE TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) 2021-12-30 — — WO disclosed
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