SCHEMBL16067751

SCHEMBL16067751

c1ccc2c(c1)ccc1cc(-c3c4ccccc4c(-c4ccc5c(c4)[nH]c4c6ccccc6c6ccccc6c54)c4ccccc34)c3ccccc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 11/20 0.42
▸ CCND1 P24385 11/20 0.42
▸ CCNE2 O96020 4/20 0.42
▸ CCNE1 P24864 4/20 0.42
▸ CDK2 P24941 4/20 0.42
▸ GSK3B P49841 2/20 0.42
▸ CCNB2 O95067 2/20 0.42
▸ CDK1 P06493 2/20 0.42
▸ CCNB1 P14635 2/20 0.42
▸ CCNB3 Q8WWL7 2/20 0.42
▸ PRKCG P05129 1/20 0.42
▸ PRKCB P05771 1/20 0.42
▸ PRKCA P17252 1/20 0.42
▸ MAP3K9 P80192 1/20 0.42
▸ MAP3K11 Q16584 1/20 0.42
▸ KIF11 P52732 1/20 0.40
▸ GABRP O00591 1/20 0.36
▸ GABRD O14764 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB1 P18505 1/20 0.36

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
SCHEMBL16067906 0.91 KIF11 (0.51) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067745 0.91 CLK1 (0.39) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067882 0.90 KIF11 (0.40) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067740 0.87 BCHE (0.39) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067755 0.87 KIF11 (0.44) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067778 0.85 HTR2B (0.46) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067760 0.85 GABRP (0.41) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067811 0.85 GABRP (0.47) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067792 0.85 KIF11 (0.50) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16067579 0.85 CDK4 (0.38) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2924029-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME Idemitsu Kosan Co., Ltd (JP) 2015-09-30 — — EP disclosed
WO-2014141725-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME 出光興産株式会社 (JP) 2014-09-18 — — WO disclosed
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