SCHEMBL11235932

SCHEMBL11235932

CN(C)c1ccc(C2(N(c3ccccc3)c3ccccc3)OC(=O)c3ncccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
CYP3A4 P08684 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPY5R Q15761 7/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
APP P05067 3/20 0.34
MAPT P10636 3/20 0.34
SNCA P37840 3/20 0.34
CRHBP P24387 2/20 0.32
CRHR2 Q13324 2/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
PRKCA P17252 1/20 0.32
PRKCE Q02156 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
SCHEMBL11228890 0.87 KMT2A (0.36) ALDH1A1HPGDNPY5RKMT2AMEN1
SCHEMBL11441974 0.81 TDP1 (0.48) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11377272 0.81 TDP1 (0.48) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11248616 0.81 ALDH1A1 (0.40) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11370697 0.78 ALDH1A1 (0.50) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11448925 0.76 ALDH1A1 (0.63) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11375868 0.76 ALDH1A1 (0.63) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11241233 0.76 HTT (0.35) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11456350 0.76 TDP1 (0.50) ALDH1A1HPGDCYP3A4HIF1AHSD17B10
SCHEMBL11374896 0.74 CYP3A4 (0.47) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US claimed
US-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US disclosed