SCHEMBL5266541

SCHEMBL5266541

COc1ccccc1N1CCN(C(=O)C2CN(S(=O)(=O)c3cc(Br)c(Br)s3)CC2c2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.51
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 3/20 0.48
POLB P06746 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 4/20 0.45
MAPT P10636 1/20 0.45
GAA P10253 2/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 2/20 0.44
TSHR P16473 1/20 0.44
THRB P10828 1/20 0.44
GFER P55789 1/20 0.42

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
SCHEMBL9926050 1.00 MC4R (0.51) MC4RKMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL5264337 0.87 THRB (0.47) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL9926112 0.87 THRB (0.47) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL9926091 0.87 MAPT (0.52) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL5264524 0.87 MAPT (0.52) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL13987559 0.87 SMN1; SMN2 (0.52) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL5265693 0.87 SMN1; SMN2 (0.52) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL9926111 0.87 MC4R (0.56) MC4RKMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL13987571 0.86 MAPT (0.62) KMT2AALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL5265503 0.85 AR (0.46) MC4RKMT2AALDH1A1POLBSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836180-B1 SULFONYL PYRROLIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS DRUGS SANOFI SA (FR) 2012-06-13 EP disclosed
EP-1836180-A2 SULFONYL PYRROLIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS DRUGS sanofi-aventis (FR) 2007-09-26 EP disclosed
WO-2006072393-A2 SULFONYL PYRROLIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS DRUGS SANOFI-AVENTIS (DE) 2006-07-13 WO disclosed