SCHEMBL9314716

SCHEMBL9314716

C=CC(=C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1)C1(c2ccc(OC)cc2)OC(=O)c2cc(N3CCCC3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
CYP3A4 P08684 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 6/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
NR4A1 P22736 1/20 0.35
RAB9A P51151 1/20 0.35
MCL1 Q07820 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
DCAF15 Q66K64 1/20 0.34
LMNA P02545 2/20 0.34
PRKCA P17252 2/20 0.34
PRKCE Q02156 2/20 0.34
RASGRP3 Q8IV61 2/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL9313534 0.95 ALDH1A1 (0.39) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9312454 0.89 CYP3A4 (0.47) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9313241 0.89 CYP3A4 (0.47) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9313090 0.83 ALDH1A1 (0.42) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9313962 0.82 ALDH1A1 (0.41) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9663554 0.79 MAPT (0.38) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9663559 0.79 MAPT (0.38) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9313965 0.79 ALDH1A1 (0.45) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9314735 0.78 ALDH1A1 (0.49) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL9314487 0.78 CYP3A4 (0.46) ALDH1A1HPGDCYP3A4HIF1AHSD17B10

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
US-5286702-A Color coupler for infrared recording YAMADA CHEMICAL CO., LTD. (JP) 1994-02-15 US disclosed