SCHEMBL28472293

SCHEMBL28472293

c1ccc(-c2ccc3cc(-c4cccc5[nH]c6ccc(-c7ccc8c9ccccc9c9ccccc9c8c7)cc6c45)ccc3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 10/20 0.53
▸ CCND1 P24385 10/20 0.53
▸ CCNB2 O95067 1/20 0.41
▸ CCNE2 O96020 1/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ CCNB1 P14635 1/20 0.41
▸ CCNE1 P24864 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCNB3 Q8WWL7 1/20 0.41
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ GABRB2 P47870 1/20 0.41
▸ GABRA4 P48169 1/20 0.41

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
SCHEMBL29888691 0.87 CDK4 (0.55) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL19494764 0.86 CDK4 (0.56) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL29888674 0.85 CDK4 (0.50) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL17277906 0.84 IMPDH2 (0.49) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL28368134 0.82 CDK4 (0.51) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL23668299 0.82 CDK4 (0.47) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL30721419 0.82 CDK4 (0.47) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL21104834 0.82 CDK4 (0.50) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL19998255 0.81 KMT2A (0.43) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL21104502 0.81 CDK4 (0.49) CDK4CCND1CCNB2CCNE2CDK1

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-109810120-B Carbazole-thienopyrazine derivative, preparation method, application and device thereof 武汉尚赛光电科技有限公司 2020-10-30 — — CN disclosed
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