SCHEMBL13619384

SCHEMBL13619384

Clc1cc(Cl)cc(-n2ccc(C3CC3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MGLL Q99685 4/20 0.39
▸ FAAH O00519 2/20 0.38
▸ KDM1A O60341 1/20 0.38
▸ NOTUM Q6P988 3/20 0.36
▸ USP30 Q70CQ3 1/20 0.34
▸ KCNJ6 P48051 1/20 0.34
▸ KCNJ5 P48544 1/20 0.34
▸ KCNJ3 P48549 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ STS P08842 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ POLB P06746 1/20 0.32

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
SCHEMBL1906269 0.77 MGLL (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29892599 0.76 HTR6 (0.47) NPC1RAB9AMGLLNOTUMKCNJ6
SCHEMBL23411539 0.76 HTR6 (0.47) NPC1RAB9AMGLLNOTUMKCNJ6
SCHEMBL19690992 0.75 NPC1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL23410958 0.74 HTR3A (0.42) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL16705086 0.74 NPC1 (0.55) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL16574209 0.73 NPC1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL23411650 0.72 MGLL (0.53) RAB9ASMN1; SMN2ALDH1A1MGLLFAAH
SCHEMBL23411383 0.72 MGLL (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1MGLL
SCHEMBL21507857 0.71 NOTUM (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1

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-2009140342-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE SCHERING CORPORATION (US) 2009-11-19 — — WO disclosed
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