SCHEMBL3633479

SCHEMBL3633479

N#Cc1ccc(-c2ccc(C3[CH]CCN(C(N)=O)C3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 2/20 0.44
KDM1A O60341 7/20 0.39
MAOB P27338 1/20 0.39
USP30 Q70CQ3 5/20 0.38
SLC6A7 Q99884 1/20 0.37
DPP4 P27487 1/20 0.37
NSD2 O96028 1/20 0.37
ALDH1A1 P00352 1/20 0.36
FASN P49327 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL3195746 0.84 SMN1; SMN2 (0.42) KDM1AMAOBSLC6A7FASN
SCHEMBL5160130 0.78 RAB9A (0.37) KDM1AALDH1A1
SCHEMBL3665330 0.74 ALDH1A1 (0.41) DPP4ALDH1A1
SCHEMBL3623060 0.73 GHSR (0.43) USP30FASN
SCHEMBL2320538 0.63 MAOA (0.40) KDM1AMAOBALDH1A1HRH3
SCHEMBL1966806 0.63 POLB (0.47) ALDH1A1
SCHEMBL16649636 0.63 MAOA (0.41) MAOBALDH1A1
SCHEMBL14813594 0.63 MAOA (0.41) KDM1AMAOBALDH1A1
SCHEMBL22680582 0.63 FASN (0.49) KDM1AUSP30ALDH1A1FASN
SCHEMBL28111674 0.63 CYP2A6 (0.42) KDM1AMAOBALDH1A1

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-2142505-A1 SULFONAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer, Inc. (US) 2010-01-13 EP disclosed
WO-2008120093-A1 SULFONAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER INC. (US) 2008-10-09 WO disclosed