SCHEMBL1989244

SCHEMBL1989244

CCc1c(OC(=O)O)nn(-c2ccc(Cl)cc2)c1-c1cc(C)cs1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
MAPT P10636 3/20 0.37
APP P05067 1/20 0.37
CASP1 P29466 1/20 0.37
PPP1CA P62136 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.36
TP53 P04637 2/20 0.36
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
NPY1R P25929 1/20 0.35
NPY2R P49146 1/20 0.35
GAA P10253 1/20 0.35
PPARA Q07869 3/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34

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
SCHEMBL1984227 0.92 KMT2A (0.36) KMT2AMAPTAPPCASP1PPP1CA
SCHEMBL1986995 0.90 KMT2A (0.35) KMT2AMAPTAPPCASP1PPP1CA
SCHEMBL1983836 0.89 PDE4D (0.38) KMT2AMAPTAPPSMN1; SMN2LMNA
SCHEMBL1986572 0.87 SMN1; SMN2 (0.39) KMT2AMAPTAPPCASP1PPP1CA
SCHEMBL1989275 0.87 CNR2 (0.43) LMNA
SCHEMBL1987824 0.85 KMT2A (0.40) KMT2AMAPTAPPCASP1PPP1CA
SCHEMBL1987131 0.84 MAPT (0.42) KMT2AMAPTAPPCASP1PPP1CA
SCHEMBL1984671 0.84 RXRA (0.39) MAPTAPPLMNATP53ALDH1A1
SCHEMBL1983550 0.82 CNR1 (0.43) KMT2AMAPTLMNATP53MEN1
SCHEMBL1988695 0.80 CNR1 (0.45) KMT2AMAPTSMN1; SMN2LMNATP53

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
EP-1602656-B1 PYRAZOLE DERIVATIVES HAVING AFFINITY FOR CB1 AND/OR CB2 RECEPTORS NEUROSCIENZE PHARMANESS S C A R L (IT) 2011-06-29 EP claimed