SCHEMBL30659227

SCHEMBL30659227

Clc1ccc2c(c1)[nH]c1ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.64
ALDH1A1 P00352 2/20 0.61
GPR3 P46089 1/20 0.61
HSD17B10 Q99714 1/20 0.61
KIF11 P52732 10/20 0.59
CCNE2 O96020 1/20 0.58
CDK4 P11802 1/20 0.58
CCND1 P24385 1/20 0.58
CCNE1 P24864 1/20 0.58
CDK2 P24941 1/20 0.58
CAMK2B Q13554 1/20 0.58
CAMK2G Q13555 1/20 0.58
CAMK2D Q13557 1/20 0.58
CAMK2A Q9UQM7 1/20 0.58
GABRP O00591 2/20 0.58
GABRD O14764 2/20 0.58
GABRA1 P14867 2/20 0.58
GABRB1 P18505 2/20 0.58
GABRG2 P18507 2/20 0.58
GABRB3 P28472 2/20 0.58

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
SCHEMBL4670015 1.00 AHR (0.64) AHRALDH1A1GPR3HSD17B10KIF11
SCHEMBL31167250 0.89 PARP1 (0.65) ALDH1A1HSD17B10PARP1LMNAHPGD
SCHEMBL6009587 0.89 PARP1 (0.65) ALDH1A1HSD17B10PARP1LMNAHPGD
SCHEMBL4231006 0.88 GAA (0.67) AHRALDH1A1CCNE2CDK4CCND1
SCHEMBL18109779 0.88 CDK4 (0.60) AHRALDH1A1GPR3HSD17B10KIF11
SCHEMBL607394 0.87 AHR (0.64) AHRALDH1A1GPR3HSD17B10KIF11
SCHEMBL29993295 0.87 AHR (0.64) AHRALDH1A1GPR3HSD17B10KIF11
SCHEMBL29643218 0.87 AHR (0.64) AHRALDH1A1GPR3HSD17B10KIF11
Methane SCHEMBL5798766 0.85 AHR (0.61) AHRALDH1A1GPR3HSD17B10KIF11
SCHEMBL24425669 0.84 CCNE2 (0.60) AHRALDH1A1KIF11CCNE2CDK4

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-117044428-A Lateral current suppressing material, carbazole compound, hole injection layer, and organic electroluminescent element 东曹株式会社 2023-11-10 CN disclosed