SCHEMBL30300692

SCHEMBL30300692

Brc1ccc(-c2ccccc2I)c2[nH]c3ccccc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 6/20 0.42
▸ CCND1 P24385 6/20 0.42
▸ CCNE2 O96020 5/20 0.42
▸ CCNE1 P24864 5/20 0.42
▸ CDK2 P24941 5/20 0.42
▸ CAMK2B Q13554 4/20 0.42
▸ CAMK2G Q13555 4/20 0.42
▸ CAMK2D Q13557 4/20 0.42
▸ CAMK2A Q9UQM7 4/20 0.42
▸ CCNB2 O95067 4/20 0.42
▸ CDK1 P06493 4/20 0.42
▸ CCNB1 P14635 4/20 0.42
▸ CCNB3 Q8WWL7 4/20 0.42
▸ PRKACA P17612 2/20 0.42
▸ PRKACG P22612 2/20 0.42
▸ PRKACB P22694 2/20 0.42
▸ MEN1 O00255 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ GABRP O00591 2/20 0.39

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
SCHEMBL28770596 0.78 CDK4 (0.51) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL29755092 0.78 CDK4 (0.51) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL28615344 0.77 PARP14 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31091073 0.73 MAPK1 (0.47) CDK4CCND1CCNE2CCNE1CDK2
Biphenyl SCHEMBL20954057 0.72 CDK4 (0.56) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL28524650 0.71 CDK5 (0.43) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL3345110 0.71 PARP14 (0.49) PARP14
SCHEMBL27986237 0.70 HPGD (0.45) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL26057058 0.70 GABRA1 (0.47) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL5022753 0.69 MAPT (0.63) CDK4CCND1CCNE2CCNE1CDK2

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-113105382-B Biphenyl modified carbazole group anthracene-based deep blue light material and preparation and application thereof 华南理工大学 2023-03-21 — — CN disclosed
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