SCHEMBL14610697

SCHEMBL14610697

CCc1ccccc1CN(CCN)C(=O)c1ccc(OCc2ccccc2)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 2/20 0.61
MAP2K1 Q02750 2/20 0.61
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TRPM8 Q7Z2W7 2/20 0.54
APP P05067 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
SMPD1 P17405 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.46
LPAR1 Q92633 1/20 0.46

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
SCHEMBL14610641 0.91 TRPM8 (0.61) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14610915 0.90 RAF1 (0.59) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14610733 0.89 RAF1 (0.58) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL5305560 0.85 MRGPRX4 (0.61) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14078347 0.84 TRPM8 (0.69) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14610918 0.83 TRPM8 (0.68) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14610711 0.83 RAF1 (0.56) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14610939 0.83 TRPM8 (0.52) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14078352 0.82 TRPM8 (0.64) RAF1MAP2K1NPC1RAB9AHPGD
SCHEMBL14610712 0.81 NPC1 (0.61) RAF1MAP2K1NPC1RAB9AHPGD

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-2007017092-A1 SUBSTITUTED 4-BENZYLOXY-BENZOIC ACID AMIDE DERIVATIVES BAYER HEALTHCARE AG (DE) 2007-02-15 WO disclosed