SCHEMBL30715261

SCHEMBL30715261

c1ccc(-c2ccc3c(c2)[nH]c2ccc(-c4ccccc4)cc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 1/20 0.54
CDK4 P11802 2/20 0.54
CCND1 P24385 2/20 0.54
AHR P35869 1/20 0.54
FEN1 P39748 1/20 0.50
JAK2 O60674 2/20 0.49
KIF11 P52732 4/20 0.46
GABRA1 P14867 3/20 0.45
GABRG2 P18507 3/20 0.45
GABRB3 P28472 3/20 0.45
GABRA5 P31644 3/20 0.45
GABRA3 P34903 3/20 0.45
GABRA2 P47869 3/20 0.45
GABRA6 Q16445 3/20 0.45
MKNK1 Q9BUB5 1/20 0.45
ALDH1A1 P00352 1/20 0.44
GPR3 P46089 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GPR17 Q13304 1/20 0.44
GABRA4 P48169 2/20 0.44

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
SCHEMBL15990082 1.00 TNKS2 (0.54) TNKS2CDK4CCND1AHRFEN1
SCHEMBL29533133 0.92 TNKS2 (0.61) TNKS2CDK4CCND1AHRFEN1
SCHEMBL533285 0.92 TNKS2 (0.61) TNKS2CDK4CCND1AHRFEN1
SCHEMBL19041639 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1
SCHEMBL12001022 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1
SCHEMBL3365890 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1
SCHEMBL29386403 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1
SCHEMBL149685 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1
SCHEMBL17154708 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1
SCHEMBL30300831 0.92 CDK4 (0.57) TNKS2CDK4CCND1AHRFEN1

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
CN-117402102-A Diamine containing carbazole moieties and polyimide gas separation membrane prepared from diamine and method 西北工业大学 2024-01-16 CN claimed
CN-117402102-A Diamine containing carbazole moieties and polyimide gas separation membrane prepared from diamine and method 西北工业大学 2024-01-16 CN disclosed