SCHEMBL13832167

SCHEMBL13832167

Cc1cccc2c(N(c3cccc4c(C)cccc34)c3ccc4c5c(cccc35)-c3ccccc3-4)cccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
PABPC1 P11940 2/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP1A2 P05177 3/20 0.43
CYP2A6 P11509 2/20 0.43
CRHBP P24387 2/20 0.42
CRHR2 Q13324 2/20 0.42
KEAP1 Q14145 2/20 0.42
NFE2L2 Q16236 2/20 0.42
ALDH1A1 P00352 6/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
HSD17B10 Q99714 5/20 0.40
USP2 O75604 4/20 0.40
CASP1 P29466 3/20 0.40
CASP7 P55210 2/20 0.40
HBB P68871 2/20 0.40
GAA P10253 1/20 0.40
BRCA1 P38398 1/20 0.40

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
SCHEMBL13832169 0.95 MAPT (0.56) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2
SCHEMBL13832166 0.88 KDM4E (0.43) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2
SCHEMBL9888902 0.81 ALDH1A1 (0.48) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2
SCHEMBL14010642 0.80 MAPT (0.41) MAPTPABPC1KDM4ESMN1; SMN2CYP2A6
SCHEMBL10053554 0.78 CYP1A2 (0.65) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2
SCHEMBL10072075 0.77 KDM4E (0.42) MAPTPABPC1KDM4ESMN1; SMN2CRHBP
SCHEMBL14010657 0.76 MAPT (0.40) MAPTPABPC1KDM4ESMN1; SMN2CRHBP
SCHEMBL14491563 0.76 KEAP1 (0.44) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2
SCHEMBL22635004 0.76 PABPC1 (0.78) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2
SCHEMBL24432437 0.75 CYP1A2 (0.42) MAPTPABPC1KDM4ESMN1; SMN2CYP1A2

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
WO-2012153083-A1 LIGHT EMITTING MATERIAL, COMPOSITION AND DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2012-11-15 WO disclosed