SCHEMBL10903120

SCHEMBL10903120

CCN(CC)c1ccccc1C1(c2ccccc2N(CC)CC)OC(=O)c2cc(N(C)C)ccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.60
TDP1 Q9NUW8 4/20 0.60
ALDH1A1 P00352 4/20 0.60
HPGD P15428 2/20 0.60
HIF1A Q16665 2/20 0.60
HSD17B10 Q99714 2/20 0.60
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
MAPT P10636 6/20 0.40
LMNA P02545 6/20 0.40
FTO Q9C0B1 4/20 0.40
NPSR1 Q6W5P4 4/20 0.40
POLB P06746 3/20 0.40
HTT P42858 2/20 0.40
CYP2C19 P33261 2/20 0.40
GPR55 Q9Y2T6 2/20 0.40
ALOX12 P18054 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
SMAD3 P84022 1/20 0.40

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
SCHEMBL2905368 0.88 ALDH1A1 (0.68) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL5188731 0.87 ALDH1A1 (0.66) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL10349315 0.87 ALDH1A1 (0.66) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL10804975 0.87 ALDH1A1 (0.66) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL10349246 0.87 ALDH1A1 (0.66) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL10349121 0.87 ALDH1A1 (0.66) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL29195462 0.83 CYP3A4 (0.52) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL9318941 0.82 ALDH1A1 (0.60) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL29381342 0.82 ALDH1A1 (0.79) CYP3A4TDP1ALDH1A1HPGDHIF1A
SCHEMBL311267 0.82 ALDH1A1 (0.79) CYP3A4TDP1ALDH1A1HPGDHIF1A

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
EP-0083075-B1 COLOUR DEVELOPING SHEET FOR A PRESSURE-SENSITIVE RECORDING SHEET JUJO PAPER CO., LTD. (JP) 1986-08-13 EP disclosed