SCHEMBL4664037

SCHEMBL4664037

Cc1cc(CCC(N)=O)on1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VHL P40337 2/20 0.47
HCAR2 Q8TDS4 1/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX2 P34913 2/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
HTT P42858 1/20 0.38
RAB9A P51151 2/20 0.38
TP53 P04637 1/20 0.38
KLF5 Q13887 1/20 0.38
PPARA Q07869 1/20 0.37
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
MMP12 P39900 1/20 0.36
PARG Q86W56 1/20 0.36
USP2 O75604 1/20 0.35

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
SCHEMBL22317120 0.84 VHL (0.49) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL1698651 0.81 VHL (0.58) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL12530275 0.81 VHL (0.46) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL2402699 0.80 MMP2 (0.36) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL22317122 0.79 VHL (0.49) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL3123403 0.79 MMP2 (0.39) MEN1KMT2ASMN1; SMN2RAB9ATP53
SCHEMBL28611482 0.77 PPARA (0.56) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL20320540 0.76 VHL (0.41) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL12753495 0.76 VHL (0.42) VHLHCAR2MEN1KMT2AEPHX2
SCHEMBL4694487 0.75

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-2007717-A1 NOVEL SULFONAMIDE COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2008-12-31 EP disclosed
WO-2007116374-A1 NOVEL SULFONAMIDE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2007-10-18 WO disclosed