SCHEMBL31160472

SCHEMBL31160472

Cc1ccc(-c2[nH]c3ncccc3c2C=O)c(-c2cccnc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 3/20 0.45
▸ SKP2 Q13309 3/20 0.45
▸ NUDT1 P36639 1/20 0.42
▸ PIK3C3 Q8NEB9 1/20 0.42
▸ CYP2A6 P11509 2/20 0.41
▸ ELANE P08246 1/20 0.41
▸ BTK Q06187 1/20 0.41
▸ MAP2K4 P45985 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ DYRK1B Q9Y463 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ ERN1 O75460 1/20 0.39
▸ CYP11B1 P15538 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ NPY5R Q15761 1/20 0.39
▸ COPS5 Q92905 1/20 0.38
▸ CCNK O75909 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
SCHEMBL31160505 0.91 COPS5 (0.43) CKS1BSKP2LMNACOPS5
SCHEMBL31160461 0.86 CKS1B (0.46) CKS1BSKP2CYP2A6BTKCYP3A4
SCHEMBL31160473 0.80 COPS5 (0.43) CKS1BSKP2LMNACOPS5
SCHEMBL1777845 0.74 ADORA2A (0.50) ERN1LMNA
SCHEMBL25871383 0.73 CYP2A6 (0.56) CYP2A6MAP2K4CYP3A4MAOAMAOB
SCHEMBL3424504 0.73 CYP2A6 (0.56) CYP2A6MAP2K4CYP3A4MAOAMAOB
SCHEMBL31160476 0.72 COPS5 (0.52) CKS1BSKP2COPS5
SCHEMBL31160463 0.72 COPS5 (0.52) CKS1BSKP2COPS5
SCHEMBL31160474 0.72 RIPK1 (0.52) DYRK1ANPY5R
SCHEMBL17009195 0.71 ERN1 (0.54) CYP2A6BTKMAP2K4CYP3A4MAOA

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
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