SCHEMBL30602806

SCHEMBL30602806

COc1nn(Cc2ccccc2)c2ccc(S(=O)(=O)Cl)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 6/20 0.50
▸ ACHE P22303 4/20 0.50
▸ CNR1 P21554 4/20 0.50
▸ KDM4E B2RXH2 1/20 0.43
▸ GUCY1B2 O75343 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ ADRA2A P08913 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ SLC6A2 P23975 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ GUCY1A2 P33402 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ GUCY1A1 Q02108 1/20 0.43

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
SCHEMBL26108490 0.87 CNR2 (0.47) CNR2ACHECNR1KDM4EGUCY1B2
SCHEMBL30602786 0.85 PTGDR2 (0.40) CNR2ACHECNR1PTGDR2
SCHEMBL30602797 0.80 CNR2 (0.53) CNR2ACHECNR1KDM4EGUCY1B2
SCHEMBL2760339 0.79 CNR2 (0.70) CNR2ACHECNR1KDM4EGUCY1B2
SCHEMBL31202808 0.74 PARG (0.43) PTGDR2
SCHEMBL26105122 0.74 PARG (0.43) PTGDR2
SCHEMBL30602781 0.71 CNR2 (0.53) CNR2ACHECNR1PDE5A
SCHEMBL14287999 0.70 MAPT (0.41) CNR1POLBPTGDR2HTR6
SCHEMBL3058157 0.70 CNR1 (0.54) CNR2ACHECNR1KDM4EGUCY1B2
SCHEMBL27821228 0.70 CNR2 (0.64) CNR2ACHECNR1KDM4EGUCY1B2

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-119095828-A Indazole compound, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2024-12-06 — — CN disclosed
WO-2023186058-A1 INDAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF IN MEDICINE 江苏恒瑞医药股份有限公司 2023-10-05 — — WO disclosed
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