SCHEMBL28469329

SCHEMBL28469329

c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-c3cccc4[nH]c5cccc(-c6ccc7ccc8ccccc8c7c6)c5c34)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 10/20 0.51
▸ CCND1 P24385 10/20 0.51
▸ 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
▸ ENPP3 O14638 1/20 0.36
▸ ENPP1 P22413 1/20 0.36
▸ ALK Q9UM73 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ CYP1B1 Q16678 1/20 0.34
▸ HPGD P15428 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ ACMSD Q8TDX5 1/20 0.34

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
SCHEMBL28466160 0.77 CDK4 (0.46) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL23945224 0.76 CDK4 (0.71) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL28466222 0.75 CDK4 (0.41) CDK4CCND1DHODH
SCHEMBL28465176 0.74 CDK4 (0.50) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL20227597 0.72 KDM4E (0.44) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL23668299 0.72 CDK4 (0.47) CDK4CCND1ALDH1A1HSD17B10
SCHEMBL30721419 0.72 CDK4 (0.47) CDK4CCND1ALDH1A1HSD17B10
SCHEMBL19041840 0.72 CDK4 (0.38) CDK4CCND1ALKALDH1A1HSD17B10
SCHEMBL26391992 0.72 CDK4 (0.43) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL22894081 0.71 CDK4 (0.54) 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
Send feedback