SCHEMBL9181702

SCHEMBL9181702

CCN(CC)c1ccc(C2(c3ccc(N(C)C)cc3C)OC(=O)c3cccnc32)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 3/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 1/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 8/20 0.36
NPSR1 Q6W5P4 3/20 0.36
MAPK1 P28482 2/20 0.36
GFER P55789 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 5/20 0.34
POLB P06746 2/20 0.34
ALOX12 P18054 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
P2RX7 Q99572 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
SCHEMBL9181598 1.00 ALDH1A1 (0.39) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9261528 0.96 MAPT (0.38) ALDH1A1HSD17B10CYP3A4MAPTNPSR1
SCHEMBL9181618 0.96 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9185743 0.93 TDP1 (0.44) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9184105 0.93 CYP3A4 (0.39) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9184678 0.93 CYP3A4 (0.39) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9184030 0.92 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9254824 0.92 ALDH1A1 (0.44) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9263278 0.91 ALDH1A1 (0.38) ALDH1A1HSD17B10CYP3A4HPGDHIF1A
SCHEMBL9185723 0.91 ALDH1A1 (0.38) ALDH1A1HSD17B10CYP3A4HPGDHIF1A

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