SCHEMBL10902115

SCHEMBL10902115

Cc1cc2c(-c3ccncc3)occ2cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.46
NPC1 O15118 8/20 0.46
LMNA P02545 1/20 0.35
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
DUSP3 P51452 1/20 0.35
PTPN11 Q06124 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.33
SRC P12931 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL10899410 0.87 NPC1 (0.40) RAB9ANPC1LMNAMAPK13MAPK12
SCHEMBL10902026 0.76 MKNK2 (0.43) RAB9ANPC1LMNAMAPK13MAPK12
SCHEMBL10899375 0.76 KMT2A (0.43) RAB9ANPC1LMNAMAPK13MAPK12
SCHEMBL10901540 0.76 NPC1 (0.40) RAB9ANPC1LMNAMAPK13MAPK12
SCHEMBL10901636 0.76 MKNK2 (0.47) RAB9ANPC1LMNAMAPK14KMT2A
SCHEMBL10903355 0.74 PDGFRB (0.47) RAB9ANPC1GAAKMT2AMEN1
SCHEMBL10902490 0.70 KMT2A (0.43) RAB9ANPC1LMNAMAPK14KMT2A
SCHEMBL10899791 0.70 MAPK14 (0.45) MAPK13MAPK12MAPK11MAPK14GAA
SCHEMBL10899817 0.70 PDGFRB (0.48) RAB9ANPC1MAPK14MAPTCYP1A2
SCHEMBL10901637 0.70 PDGFRB (0.48) RAB9ANPC1MAPK13MAPK12MAPK11

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4600719-A Tetrahydropyridine and piperidine derivatives CIBA GEIGY CORPORATION (US) 1986-07-15 US disclosed
US-4210655-A Anti-depressant benzofuranyl piperidines CIBA-GEIGY CORPORATION (US) 1980-07-01 US disclosed