SCHEMBL11324820

SCHEMBL11324820

CC(=O)N1CCCc2ccc(S(=O)(=O)C(Cl)(Cl)Cl)cc2C1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.47
NOTUM Q6P988 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
RIPK1 Q13546 3/20 0.42
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MCHR1 Q99705 1/20 0.41
TP53 P04637 1/20 0.41
NPC1 O15118 1/20 0.41
MITF O75030 1/20 0.41
RAB9A P51151 1/20 0.41
HDAC6 Q9UBN7 1/20 0.39
LMNA P02545 5/20 0.39
USP2 O75604 1/20 0.39
HTT P42858 1/20 0.39
TSHR P16473 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PKM P14618 1/20 0.37

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
SCHEMBL11550415 0.88 NOTUM (0.43) NOTUMHRH3RIPK1ALDH1A1SMN1; SMN2
SCHEMBL11322167 0.86 NOTUM (0.47) NOTUMHRH3RIPK1ALDH1A1SMN1; SMN2
SCHEMBL11325713 0.84 NOTUM (0.48) PNMTNOTUMHRH3RIPK1ALDH1A1
SCHEMBL11336330 0.83 CA1 (0.56) PNMTNOTUMHRH3ALDH1A1SMN1; SMN2
SCHEMBL11490867 0.80 NOTUM (0.52) NOTUMHRH3SMN1; SMN2LMNAHTT
SCHEMBL1074701 0.78 NOTUM (0.56) NOTUMHRH3ALDH1A1SMN1; SMN2MCHR1
SCHEMBL11343266 0.77 MCHR1 (0.56) NOTUMHRH3RIPK1MCHR1
SCHEMBL11335503 0.77 NOTUM (0.43) NOTUMHRH3RIPK1MCHR1HDAC6
SCHEMBL11322244 0.76 NOTUM (0.44) NOTUMHRH3RIPK1MCHR1HDAC6
SCHEMBL11478363 0.76 NOTUM (0.58) PNMTNOTUMHRH3SMN1; SMN2LMNA

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-0002624-B1 2-BENZAZEPINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BECKMAN CORPORATION (US) 1981-10-14 EP disclosed
EP-0002624-A1 2-Benzazepine compounds, processes for their preparation and pharmaceutical compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1979-06-27 EP disclosed