SCHEMBL16601993

SCHEMBL16601993

CCOC(=O)c1ccc2c3c(ccc(C(=O)OCC)c13)/C(=N/c1ccccc1CCO)C2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
USP2 O75604 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK10 P53779 1/20 0.39
PTK2B Q14289 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 4/20 0.35
NPC1 O15118 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL16601688 0.95 MAPT (0.37) MAPTMEN1KMT2AUSP2CYP1A2
SCHEMBL16601687 0.79 KMT2A (0.32) KMT2A
SCHEMBL15764219 0.79 KMT2A (0.32) KMT2A
SCHEMBL15764217 0.76 GABRP (0.38) MAPTMEN1KMT2ACYP2C9CYP2C19
SCHEMBL16601695 0.75 ALDH1A1 (0.43) MAPTMEN1KMT2ACYP1A2CYP3A4
SCHEMBL15764212 0.68 S100A4 (0.45) MAPTALDH1A1HPGD
SCHEMBL9505270 0.67 TSHR (0.68) MAPTMEN1KMT2AUSP2CYP1A2
SCHEMBL16601740 0.65
SCHEMBL15764221 0.65
SCHEMBL20730321 0.63 TSHR (0.62) CYP3A4TSHRALDH1A1HSD17B10KDM4E

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-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed