SCHEMBL28201526

SCHEMBL28201526

c1ccc(C(c2ccccc2)c2ccc3[nH]c4ccccc4c3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.55
ALDH1A1 P00352 2/20 0.52
HSD17B10 Q99714 2/20 0.52
GPR3 P46089 1/20 0.52
KIF11 P52732 7/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 1/20 0.50
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
CNR1 P21554 1/20 0.46
TP53 P04637 1/20 0.43
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42

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
SCHEMBL28363827 0.96 AHR (0.59) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL10358233 0.85 KIF11 (0.45) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL18364663 0.82 KIF11 (0.57) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL18364653 0.82 AHR (0.52) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL25129967 0.80 CNR1 (0.41) AHRALDH1A1KIF11MEN1KMT2A
SCHEMBL13010630 0.79 KIF11 (0.79) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL31549973 0.79 KIF11 (0.79) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL3142829 0.78 KIF11 (0.49) AHRALDH1A1HSD17B10KIF11MEN1
SCHEMBL869228 0.76 KIF11 (0.59) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL15697539 0.76 KIF11 (0.59) AHRALDH1A1HSD17B10GPR3KIF11

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107602443-B 1, omega-bis (3, 6-diaryl carbazolyl) -alkane and preparation method thereof 深圳大学 2020-07-07 CN disclosed
CN-107819084-B Light-emitting device based on 1, omega-bis (3, 6-diaryl carbazolyl) -alkane 深圳大学 2020-07-07 CN disclosed
CN-107819084-A Luminescent device of the one kind based on double (the 3,6 diaryl carbazyl) alkane of 1, ω 深圳大学 2018-03-20 CN disclosed
CN-107602443-A 1, ω double (3,6 diaryl carbazyl) alkane and preparation method thereof 深圳大学 2018-01-19 CN disclosed