SCHEMBL9185141

SCHEMBL9185141

CCN(CC)c1ccc(C2(c3ccc(N(CC)CC)cc3OC)OC(=O)c3cccnc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GHSR Q92847 2/20 0.36
CES2 O00748 2/20 0.35
CTSD P07339 4/20 0.35
BACE1 P56817 4/20 0.35
BACE2 Q9Y5Z0 4/20 0.35
REN P00797 1/20 0.35
MAPT P10636 4/20 0.34
NPSR1 Q6W5P4 3/20 0.34
GAA P10253 3/20 0.34
HTT P42858 2/20 0.34
MAPK1 P28482 2/20 0.34

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
SCHEMBL9180534 0.95 ALDH1A1 (0.47) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9185749 0.95 ALDH1A1 (0.47) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9184030 0.94 ALDH1A1 (0.41) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9255478 0.92 CYP3A4 (0.39) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9181618 0.90 ALDH1A1 (0.41) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9261528 0.90 MAPT (0.38) ALDH1A1CYP3A4HSD17B10L3MBTL1GHSR
SCHEMBL9184143 0.88 GHSR (0.38) ALDH1A1CYP3A4HPGDTDP1L3MBTL1
SCHEMBL9184164 0.87 CYP3A4 (0.47) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9179828 0.87 CYP3A4 (0.47) ALDH1A1CYP3A4HPGDHSD17B10HIF1A
SCHEMBL9185658 0.87 TDP1 (0.55) ALDH1A1CYP3A4HPGDHSD17B10HIF1A

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