SCHEMBL6236523

SCHEMBL6236523

CCOC(=O)/C(C)=C/C(C)=C/c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.50
KMT2A Q03164 7/20 0.49
MEN1 O00255 4/20 0.49
LMNA P02545 9/20 0.47
MAPT P10636 9/20 0.47
KDM4E B2RXH2 4/20 0.46
NPSR1 Q6W5P4 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MAPK1 P28482 3/20 0.46
S1PR4 O95977 1/20 0.46
S1PR1 P21453 1/20 0.46
ALDH1A1 P00352 3/20 0.46
MAOB P27338 1/20 0.45
PKM P14618 1/20 0.45
PTGS2 P35354 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL6236528 1.00 GLO1 (0.50) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL3034226 0.89 GLO1 (0.54) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL3034223 0.89 GLO1 (0.54) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL1856657 0.82 GLO1 (0.66) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL9296584 0.81 GLO1 (0.73) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL28627286 0.81 MAOB (0.50) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL9296374 0.81 GLO1 (0.73) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL6236217 0.81 MAPT (0.60) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL9296381 0.81 GLO1 (0.73) GLO1KMT2AMEN1LMNAMAPT
SCHEMBL6236215 0.81 MAPT (0.60) GLO1KMT2AMEN1LMNAMAPT

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
WO-2005011661-A1 PHARMACEUTICAL AGENTS UNIVERSITY COLLEGE LONDON (GB) 2005-02-10 WO disclosed