SCHEMBL27908985

SCHEMBL27908985

Cc1ccc2cc(Cl)cc(Br)c2c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.41
CYP2A6 P11509 4/20 0.41
LMNA P02545 3/20 0.39
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
F12 P00748 1/20 0.34
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL26205353 0.78 CYP1A2 (0.42) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL11495194 0.77 CYP1A2 (0.46) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL26205352 0.76 ALDH1A1 (0.46) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL8154443 0.76 ALDH1A1 (0.46) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL30064860 0.72 CYP2A6 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10TDP1
SCHEMBL31566436 0.72 CYP2A6 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10TDP1
SCHEMBL2723074 0.72 CYP2A6 (0.52) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL11797557 0.72 CYP2A6 (0.44) CYP1A2CYP2A6ALDH1A1HSD17B10TDP1
SCHEMBL27590342 0.72 CYP2A6 (0.42) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL32664327 0.72 CYP1A2 (0.50) CYP1A2CYP2A6LMNAALDH1A1KDM4E

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-103183711-A Di-triaromatic amine-substituted phosphonooxy benzophenanthrene compounds, intermediates and preparation method and application KUNSHAN VISIONOX DISPLAY TECH 2013-07-03 CN disclosed