SCHEMBL31006523

SCHEMBL31006523

O=c1c2ccc(-c3ccncc3)cc2ccn1Cc1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 2/20 0.47
▸ HTR6 P50406 2/20 0.44
▸ LMNA P02545 4/20 0.43
▸ MKNK1 Q9BUB5 2/20 0.43
▸ MKNK2 Q9HBH9 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ GRK2 P25098 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ HSP90AB1 P08238 1/20 0.41
▸ ROCK2 O75116 1/20 0.40
▸ ROCK1 Q13464 1/20 0.40
▸ BRD4 O60885 1/20 0.38
▸ CHEK1 O14757 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ CDK4 P11802 1/20 0.38
▸ CCNA2 P20248 1/20 0.38
▸ CCND1 P24385 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ CCND3 P30281 1/20 0.38

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
SCHEMBL29283862 1.00 GRM2 (0.47) GRM2HTR6LMNAMKNK1MKNK2
SCHEMBL31006542 0.90 HSP90AB1 (0.46) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL29283860 0.90 HSP90AB1 (0.46) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL29283809 0.89 THRB (0.45) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL31006555 0.88 GRM2 (0.64) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL29283822 0.88 GRM2 (0.64) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL29283818 0.87 THRB (0.42) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL31006549 0.87 THRB (0.42) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL31006540 0.87 THRB (0.43) GRM2LMNAMKNK1MKNK2TP53
SCHEMBL29283814 0.87 THRB (0.43) GRM2LMNAMKNK1MKNK2TP53

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
CN-118184635-A Quinolinone compound, pharmaceutical composition and application thereof 安徽医科大学 2024-06-14 — — CN disclosed
Send feedback