SCHEMBL9182188

SCHEMBL9182188

CCN(CC)c1ccc(C2(c3ccc(N(C)C)cc3)OC(=O)c3ncccc32)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
HIF1A Q16665 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.37
GHSR Q92847 1/20 0.33
MAPT P10636 3/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
GFER P55789 3/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL9184752 0.95 ALDH1A1 (0.39) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9178156 0.93 ALDH1A1 (0.39) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9182245 0.92 ALDH1A1 (0.50) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9184770 0.91 ALDH1A1 (0.41) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
SCHEMBL9185575 0.87 CYP3A4 (0.35) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9182528 0.87 ALDH1A1 (0.45) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9185316 0.86 CYP3A4 (0.48) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9180534 0.86 ALDH1A1 (0.47) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9178734 0.86 ALDH1A1 (0.42) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL9185712 0.85 CYP3A4 (0.38) ALDH1A1CYP3A4HPGDHIF1AHSD17B10

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-5401699-A Thermosensitive elements with color developers, fluoran derivatives and azaphthalides KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1995-03-28 US disclosed