SCHEMBL28524650

SCHEMBL28524650

Ic1ccccc1-c1cc2occc2c2c1[nH]c1ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK5 Q00535 5/20 0.43
▸ CDK5R1 Q15078 4/20 0.43
▸ DYRK1A Q13627 2/20 0.42
▸ GSK3A P49840 2/20 0.42
▸ GSK3B P49841 2/20 0.42
▸ CHEK1 O14757 3/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ CDK4 P11802 3/20 0.37
▸ CCND1 P24385 3/20 0.37
▸ PRKCA P17252 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ PRKD3 O94806 1/20 0.37
▸ CCNB2 O95067 1/20 0.37
▸ CCNE2 O96020 1/20 0.37
▸ PRKCG P05129 1/20 0.37
▸ PRKCB P05771 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ CCNB1 P14635 1/20 0.37
▸ PRKACA P17612 1/20 0.37

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
SCHEMBL28909046 0.77 CDK4 (0.41) DYRK1ACHEK1MEN1KMT2ACDK4
SCHEMBL30300692 0.71 CDK4 (0.42) CDK5CDK5R1DYRK1AGSK3AGSK3B
SCHEMBL28615344 0.70 PARP14 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL20426692 0.68 GABRP (0.49) MEN1KMT2ACDK4CCND1MAPT
SCHEMBL28060891 0.67 PARP14 (0.46) MEN1KMT2AMAPTGABRPGABRD
SCHEMBL26057058 0.66 GABRA1 (0.47) CHEK1CDK4CCND1CCNB2CCNE2
SCHEMBL30560782 0.65 KIF11 (0.55) MEN1KMT2AMAPTGABRPGABRD
SCHEMBL2050391 0.65 KIF11 (0.55) MEN1KMT2AMAPTGABRPGABRD
SCHEMBL17228829 0.64 PRKCA (0.61) CDK5CDK5R1GSK3AGSK3BCHEK1
SCHEMBL2627635 0.62 CHEK1 (0.67) CDK5CDK5R1DYRK1AGSK3AGSK3B

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-112442044-A Bipolar green phosphorescent main material and organic electroluminescent device 南京高光半导体材料有限公司 2021-03-05 — — CN disclosed
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