SCHEMBL1986572

SCHEMBL1986572

Cc1csc(-c2c(C)c(OC(=O)O)nn2-c2ccc(Cl)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
PPP1CA P62136 1/20 0.39
MAPT P10636 4/20 0.38
TP53 P04637 3/20 0.38
GAA P10253 3/20 0.38
VDR P11473 1/20 0.37
KMT2A Q03164 3/20 0.35
MALT1 Q9UDY8 3/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 2/20 0.35
RPA1 P27694 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
CNR1 P21554 1/20 0.35
APP P05067 1/20 0.35
CASP1 P29466 1/20 0.35
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
CCKAR P32238 2/20 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
SCHEMBL1985554 0.92 MAPT (0.39) SMN1; SMN2PPP1CAMAPTTP53GAA
SCHEMBL1983442 0.90 MAPT (0.37) SMN1; SMN2PPP1CAMAPTTP53GAA
SCHEMBL1984758 0.88 MAPT (0.40) SMN1; SMN2MAPTTP53KMT2AMEN1
SCHEMBL1989244 0.87 KMT2A (0.37) SMN1; SMN2PPP1CAMAPTTP53GAA
SCHEMBL1987373 0.86 CNR2 (0.43) LMNACNR1
SCHEMBL1985425 0.84 MALT1 (0.40) SMN1; SMN2MAPTKMT2AMALT1LMNA
SCHEMBL1986571 0.83 CYP1A2 (0.46) SMN1; SMN2PPP1CAMAPTGAAMALT1
SCHEMBL1983557 0.83 MAPT (0.38) SMN1; SMN2PPP1CAMAPTTP53GAA
SCHEMBL1986855 0.82 CNR1 (0.41) SMN1; SMN2PPP1CAMAPTTP53GAA
SCHEMBL1986352 0.80 CNR1 (0.42) SMN1; SMN2PPP1CAMAPTTP53GAA

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