SCHEMBL11479865

SCHEMBL11479865

O=c1oc2cccc(O)c2c(O)c1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.58
MEN1 O00255 8/20 0.58
KMT2A Q03164 8/20 0.58
MAPT P10636 7/20 0.58
ALOX15 P16050 5/20 0.58
HPGD P15428 5/20 0.58
KDM4E B2RXH2 5/20 0.58
MAPK1 P28482 4/20 0.58
HSD17B10 Q99714 4/20 0.58
TP53 P04637 3/20 0.58
LMNA P02545 2/20 0.58
USP2 O75604 2/20 0.58
AR P10275 3/20 0.54
PKM P14618 3/20 0.54
CYP1B1 Q16678 3/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP1A1 P04798 2/20 0.54
CYP1A2 P05177 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
FTO Q9C0B1 2/20 0.54

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
SCHEMBL18118643 0.97 CYP3A4 (0.55) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL29038494 0.83 MEN1 (0.63) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL29466790 0.79 MAOB (0.70) CYP3A4MEN1KMT2AALOX15KDM4E
SCHEMBL669375 0.79 MAOB (0.70) CYP3A4MEN1KMT2AALOX15KDM4E
SCHEMBL31457155 0.78 MAOA (0.52) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL471846 0.78 MAOA (0.52) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL1607111 0.77 MEN1 (0.62) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL31344371 0.77 MEN1 (0.62) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL11477475 0.75 ADORA3 (0.53) CYP3A4MEN1KMT2AMAPTALOX15
SCHEMBL7797188 0.75 CA12 (0.48) CYP3A4MEN1KMT2AMAPTALOX15

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-4230850-A HYPOTENSIVE AGENTS, VASODILATION LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1980-10-28 US disclosed