SCHEMBL3244937

SCHEMBL3244937

CC(I)OC(=O)c1cc(N)cc2sc3ccccc3c(=O)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.45
MAOB P27338 8/20 0.45
MAPT P10636 6/20 0.43
ALDH1A1 P00352 6/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
GAA P10253 2/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 4/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
GLA P06280 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
SCHEMBL3635172 0.86 MAOB (0.45) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL11166111 0.84 ALDH1A1 (0.50) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL3246703 0.84 MAOA (0.46) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL4431580 0.82 MAOA (0.41) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL29501105 0.81 GABRP (0.48) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL51940 0.81 GABRP (0.48) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL3251039 0.76 MAOA (0.36) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL29052637 0.72 GABRP (0.40) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL28543803 0.71 ALDH1A1 (0.51) MAOAMAOBMAPTALDH1A1MEN1
SCHEMBL11167133 0.70 MAPT (0.53) MAOAMAOBMAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2190887-A1 PHOTOINITIATORS FOR ENERGY CURING Lamberti Spa (IT) 2010-06-02 EP disclosed
WO-2009037130-A1 PHOTOINITIATORS FOR ENERGY CURING LAMBERTI SPA (IT) 2009-03-26 WO disclosed
EP-1957457-A1 OXIME ESTER PHOTOINITIATORS Ciba Holding Inc. (CH) 2008-08-20 EP disclosed
WO-2007062963-A1 OXIME ESTER PHOTOINITIATORS CIBA HOLDING INC. (CH) 2007-06-07 WO disclosed