SCHEMBL5149580

SCHEMBL5149580

CCC(CC)NC(=O)Nc1ccc(Oc2cccc(NC(=O)O)c2)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.53
FPR2 P25090 1/20 0.49
MEN1 O00255 3/20 0.49
MAPT P10636 3/20 0.49
KMT2A Q03164 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
BRAF P15056 2/20 0.45
GAA P10253 1/20 0.45
THRB P10828 1/20 0.45
RAF1 P04049 1/20 0.45
KDR P35968 1/20 0.45
C5 P01031 1/20 0.44
PDGFRA P16234 1/20 0.44

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
SCHEMBL4683708 0.90 PKM (0.63) PKMFPR2MEN1MAPTKMT2A
SCHEMBL5149842 0.90 PKM (0.63) PKMFPR2MEN1MAPTKMT2A
SCHEMBL5184118 0.87 PKM (0.53) PKMFPR2MEN1MAPTKMT2A
SCHEMBL4228811 0.81 PKM (0.60) PKMFPR2MEN1MAPTKMT2A
SCHEMBL4233456 0.81 PKM (0.63) PKMFPR2MEN1MAPTKMT2A
SCHEMBL4226971 0.81 PKM (0.60) PKMFPR2MEN1MAPTKMT2A
SCHEMBL4688139 0.81 MAPT (0.49) MEN1MAPTKMT2ANPC1RAB9A
SCHEMBL5149593 0.81 PKM (0.58) PKMKMT2AALDH1A1
Ammonia Solution, Strong SCHEMBL4235457 0.81 PKM (0.58) PKMFPR2MEN1MAPTKMT2A
SCHEMBL4229112 0.80 PKM (0.57) PKMFPR2MEN1MAPTKMT2A

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-2007071840-A2 COMPOUNDS BASED ON FOUR AROMATIC RINGS, PREPARATION AND USES THEREOF CEREP (FR) 2007-06-28 WO disclosed