SCHEMBL4065169

SCHEMBL4065169

Cc1cc(Cl)ccc1Oc1ccc(NC(=O)c2cccnc2)cn1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.57
MAPK1 P28482 2/20 0.56
LMNA P02545 1/20 0.56
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
BRAF P15056 1/20 0.54
NPC1 O15118 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP11B2 P19099 1/20 0.54
MAPT P10636 1/20 0.53
GRM8 O00222 1/20 0.53
GRM7 Q14831 1/20 0.53
GRM4 Q14833 1/20 0.53
GALR3 O60755 1/20 0.52
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GRM5 P41594 1/20 0.51

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
SCHEMBL4060811 0.89 GRM8 (0.56) RAB9AKMT2AMEN1NPC1MAPT
SCHEMBL4067290 0.89 GRM8 (0.53) RAB9AMAPK1LMNAKMT2AMEN1
SCHEMBL4064115 0.86 GRM8 (0.52) RAB9ALMNAKMT2AMEN1NPC1
SCHEMBL4058614 0.83 GRM8 (0.53) LMNAGRM8GRM7GRM4
SCHEMBL4063387 0.83 NPC1 (0.53) RAB9AKMT2AMEN1NPC1MAPT
SCHEMBL4069994 0.82 NPC1 (0.54) RAB9ALMNAKMT2AMEN1BRAF
SCHEMBL4061697 0.82 GRM8 (0.55) LMNAGRM8GRM7GRM4
SCHEMBL4062244 0.82 PNLIP (0.60) RAB9AKMT2AMEN1NPC1CYP11B2
SCHEMBL4065181 0.81 GRM4 (0.57) KMT2AMEN1GRM8GRM7GRM4
SCHEMBL15093308 0.81 MEN1 (0.60) MAPK1LMNAKMT2AMEN1NPC1

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
EP-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP disclosed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP disclosed