SCHEMBL751552

SCHEMBL751552

CNCc1ccc(-c2cccc(C(N)=O)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.55
CNR1 P21554 1/20 0.53
CSF1R P07333 1/20 0.51
FLT1 P17948 1/20 0.51
FLT3 P36888 1/20 0.51
TRPV1 Q8NER1 2/20 0.51
MGLL Q99685 1/20 0.51
EPHX2 P34913 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
FAAH O00519 1/20 0.48
ERN1 O75460 1/20 0.48
PARP1 P09874 2/20 0.47
ADAMTS4 O75173 1/20 0.47
DHODH Q02127 2/20 0.47
PLAU P00749 1/20 0.46
PLAT P00750 1/20 0.46
ASH1L Q9NR48 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
SCHEMBL1347900 0.84 CNR1 (0.55) NR3C2CNR1EPHX2NR1H4FAAH
SCHEMBL10243641 0.83 BCL2 (0.55) NR3C2CNR1CSF1RFLT1FLT3
SCHEMBL10243328 0.83 BCL2 (0.55) NR3C2CNR1CSF1RFLT1FLT3
SCHEMBL13929187 0.82 ERN1 (0.52) NR3C2CNR1CSF1RFLT1FLT3
SCHEMBL27352380 0.82 ERN1 (0.54) CNR1CSF1RFLT1FLT3TRPV1
SCHEMBL2570385 0.82 NOS1 (0.54) PARP1SLC6A2SLC6A4SLC6A3
SCHEMBL1345554 0.81 DPP4 (0.52) NR3C2CNR1CSF1RFLT1FLT3
SCHEMBL1345869 0.81 ALDH1A1 (0.51) NR3C2CNR1CSF1RFLT1FLT3
SCHEMBL1348033 0.81 CSF1R (0.57) NR3C2CNR1CSF1RFLT1FLT3
SCHEMBL30504326 0.81 ERN1 (0.53) NR3C2CNR1CSF1RFLT1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138209-B2 Substituted picolinamides as MAO-B inhibitors useful for treating obesity JENRIN DISCOVERY, INC. (US) 2012-03-20 US disclosed