SCHEMBL10604255

SCHEMBL10604255

COc1ccc(OC2(C=C(c3ccc(N(C)C)cc3)c3ccc(N(C)C)cc3)OC(=O)c3cc(N(C)C)ccc32)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.42
ALDH1A1 P00352 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
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
MAPT P10636 2/20 0.36
USP2 O75604 1/20 0.36
MAPK1 P28482 1/20 0.36
TLR9 Q9NR96 1/20 0.36

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
SCHEMBL10691898 0.80 MEN1 (0.45) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL10691280 0.80 CYP3A4 (0.49) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL10606214 0.76 CYP3A4 (0.51) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL1617995 0.74 ALDH1A1 (0.56) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL338334 0.71 ALDH1A1 (0.59) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL9313469 0.70 MEN1 (0.42) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL9314487 0.70 CYP3A4 (0.46) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL10692785 0.69 CYP3A4 (0.69) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL10604959 0.68 ALDH1A1 (0.54) CYP3A4ALDH1A1HPGDHIF1AHSD17B10
SCHEMBL1618101 0.68 ALDH1A1 (0.46) CYP3A4ALDH1A1HPGDHIF1AHSD17B10

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-0127203-B1 NEW PHTHALIDE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND RECORDING SYSTEM UTILIZING THE SAME AS COLOURLESS CHROMOGENIC MATERIAL KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1989-06-28 EP disclosed