SCHEMBL31160459

SCHEMBL31160459

Cc1ccc(-c2cc3cccnc3n2S(=O)(=O)c2ccccc2)c(-c2cccnc2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTR6 P50406 2/20 0.41
CCNE1 P24864 2/20 0.41
CDK2 P24941 2/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.40
CYP2A6 P11509 1/20 0.40
ELANE P08246 1/20 0.40
CKS1B P61024 1/20 0.40
SKP2 Q13309 1/20 0.40
PTGS2 P35354 2/20 0.39
PTGS1 P23219 1/20 0.39
RECQL P46063 1/20 0.39
GBA1 P04062 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LATS1 O95835 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37

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
SCHEMBL31160496 0.93 L3MBTL1 (0.46) L3MBTL1CYP2C19CCNE1CDK2PTGDR2
SCHEMBL31160500 0.86 CKS1B (0.41) L3MBTL1CYP2C19CCNE1CDK2PTGDR2
SCHEMBL30405579 0.85 CYP2C19 (0.51) CYP2C19HTR6CCNE1CDK2PTGDR2
SCHEMBL8126772 0.79 CYP2C19 (0.57) L3MBTL1CYP2C19CCNE1CDK2PTGDR2
SCHEMBL1772416 0.74 CYP2C19 (0.56) L3MBTL1CYP2C19HTR6CCNE1CDK2
SCHEMBL30337641 0.74 CYP2C19 (0.56) L3MBTL1CYP2C19HTR6CCNE1CDK2
SCHEMBL20783100 0.72 HTR6 (0.49) CYP2C19HTR6PTGDR2CYP2A6PTGS2
SCHEMBL28043326 0.72 SLC40A1 (0.47) CYP2C19HTR6CCNE1CDK2PTGDR2
SCHEMBL31160484 0.71 PTGDR2 (0.46) L3MBTL1CYP2C19PTGDR2CKS1BSKP2
SCHEMBL27687970 0.71 L3MBTL1 (0.48) L3MBTL1CYP2C19HTR6CCNE1CDK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119019389-B 7-Azaindole compound and synthetic method and application thereof SICHUAN UNIVERSITY (CN) 2026-05-26 CN disclosed
CN-119019389-A 7-Azaindole compound and synthetic method and application thereof 四川大学 2024-11-26 CN disclosed