SCHEMBL3634873

SCHEMBL3634873

C(#Cc1ccccc1)CN1CCOCC1

nearest known ligand 0.97

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
MAPK1 P28482 1/20 0.55
RAB9A P51151 1/20 0.55
GRM5 P41594 2/20 0.49
POLB P06746 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
HRH3 Q9Y5N1 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2B Q13224 1/20 0.47

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
SCHEMBL14485306 0.83 LMNA (0.81) LMNAMAPK1RAB9AHRH3MEN1
SCHEMBL28393218 0.83 LMNA (0.58) LMNAHRH3SMN1; SMN2KMT2A
SCHEMBL996088 0.83 LMNA (0.53) LMNAMAPK1RAB9AHRH3
SCHEMBL24474658 0.83 LMNA (0.58) LMNARAB9APOLBHRH3SMN1; SMN2
SCHEMBL24474667 0.83 LMNA (0.58) LMNAMAPK1RAB9AHRH3GRIN1
SCHEMBL5730065 0.81 LMNA (0.78) LMNAMAPK1RAB9AGRM5HRH3
SCHEMBL6158667 0.81 LMNA (0.44) LMNAMAPK1RAB9AHRH3SMN1; SMN2
SCHEMBL31673107 0.81 CYP2A6 (0.51) LMNAGRM5
SCHEMBL25747232 0.80 LMNA (0.64) LMNAGRM5HRH3
SCHEMBL25376554 0.79 FFAR1 (0.50) LMNAMAPK1RAB9AHRH3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111875552-B Amino-substituted 1,2, 3-triazole compound and synthesis method and application thereof 海南师范大学 2022-06-21 CN disclosed
CN-110590627-B Synthesis method of 3-aryl thiopropionamide derivative 温州大学 2022-01-14 CN disclosed
CN-111875552-A Amino-substituted 1,2, 3-triazole compound and synthesis method and application thereof 海南师范大学 2020-11-03 CN disclosed
CN-110590627-A Synthesis method of 3-aryl thiopropionamide derivative 温州大学 2019-12-20 CN disclosed
CN-103408433-A Method for synthesizing propargylamine compounds UNIV HUNAN 2013-11-27 CN disclosed
EP-2142552-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME Abbott Laboratories (US) 2010-01-13 EP disclosed
WO-2008134690-A1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBOTT LABORATORIES (US) 2008-11-06 WO disclosed