SCHEMBL8608702

SCHEMBL8608702

COc1cc(C=C(C#N)C(N)=O)ccc1O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.82
ALDH1A1 P00352 6/20 0.69
MEN1 O00255 6/20 0.69
KMT2A Q03164 6/20 0.69
MAPT P10636 6/20 0.69
EGFR P00533 2/20 0.69
HPGD P15428 2/20 0.69
KDM4E B2RXH2 2/20 0.69
TDP1 Q9NUW8 2/20 0.69
ERBB2 P04626 1/20 0.69
TP53 P04637 1/20 0.69
LCK P06239 1/20 0.69
HSD17B10 Q99714 1/20 0.69
KLK7 P49862 2/20 0.65
CSNK2A1 P68400 3/20 0.63
KLK14 Q9P0G3 1/20 0.63
KLK5 Q9Y337 1/20 0.63
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61

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
SCHEMBL8608700 1.00 CYP1A2 (0.82) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL11758901 0.90 CYP1A2 (1.00) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL11758889 0.90 CYP1A2 (1.00) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL11758893 0.90 CYP1A2 (1.00) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL5597271 0.87 KMT2A (0.70) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL5328416 0.87 KMT2A (0.70) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL6874677 0.86 MEN1 (0.77) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL6874673 0.86 MEN1 (0.77) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL9644187 0.83 MEN1 (0.62) CYP1A2ALDH1A1MEN1KMT2AMAPT
SCHEMBL9644186 0.83 MEN1 (0.62) CYP1A2ALDH1A1MEN1KMT2AMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007013649-A1 HEAT-SENSITIVE TRANSFER IMAGE-RECEIVING SHEET AND METHOD OF PRODUCING THE SAME FUJIFILM CORPORATION (JP) 2007-02-01 WO disclosed
EP-0555465-B1 RADIOGRAPHIC ELEMENT EASTMAN KODAK CO (US) 1998-04-01 EP disclosed
US-5215876-A Optical recording media has addition-condensation copolymer to reduce light transmission EASTMAN KODAK COMPANY (US) 1993-06-01 US disclosed