SCHEMBL7649111

SCHEMBL7649111

NC(=O)C(CCc1ccccc1)NC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
MME P08473 1/20 0.48
HPGD P15428 2/20 0.47
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
ACE P12821 1/20 0.47
TSHR P16473 1/20 0.46
ERAP1 Q9NZ08 5/20 0.45
ERAP2 Q6P179 4/20 0.45
LNPEP Q9UIQ6 2/20 0.45
ANPEP P15144 2/20 0.45
IL1RN P18510 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL2558591 0.87 ALB (0.49) CNR2SMN1; SMN2HPGDMEN1HTT
SCHEMBL3718009 0.86 SMN1; SMN2 (0.52) CNR2SMN1; SMN2MMEHPGDMEN1
SCHEMBL21314275 0.86 ERAP2 (0.49) CNR2SMN1; SMN2ERAP1ERAP2LNPEP
SCHEMBL21314310 0.86 ERAP2 (0.49) CNR2SMN1; SMN2ERAP1ERAP2LNPEP
SCHEMBL14350869 0.86 MME (0.58) CNR2SMN1; SMN2MMEHPGDMEN1
SCHEMBL24533878 0.85 MMP2 (0.58) CNR2HTTALDH1A1
SCHEMBL24533867 0.85 MMP2 (0.58) CNR2HTTALDH1A1
SCHEMBL5721977 0.84 TSHR (0.51) CNR2SMN1; SMN2MMEHPGDMEN1
SCHEMBL24183729 0.84 CNR2 (0.49) CNR2SMN1; SMN2HPGDMEN1HTT
SCHEMBL14441431 0.84 CTSC (0.51) ERAP1ERAP2LNPEPIL1RN

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-6358978-B1 FOR THERAPY AND PROPHYLAXIS OF RHEUMATOID ARTHRITIS (IN THE CASE OF INFLAMMATION), OSTEOARTHRITIS, ASTHMA, CARDIAC INFARCT, ALZHEIMER'S DISEASE, OR ATHEROSCLEROSIS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-03-19 US disclosed