SCHEMBL8347364

SCHEMBL8347364

COc1ccc(Cc2ccc3c(c2)C(=O)N(Cc2ccc(Cl)cc2)C3)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 5/20 0.48
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
POLB P06746 2/20 0.43
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 2/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
APAF1 O14727 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
CHRM5 P08912 1/20 0.41

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
SCHEMBL6442206 0.86 ADAM17 (0.56) ADAM17POLBGAAKMT2AMEN1
SCHEMBL21768166 0.83 ADAM17 (0.48) ADAM17DRD2DRD4POLBMAPK1
SCHEMBL14991264 0.83 GAA (0.47) ADAM17POLBMAPK1ALDH1A1LMNA
SCHEMBL6765847 0.82 ADAM17 (0.46) ADAM17DRD2DRD4
SCHEMBL31039229 0.82 ADAM17 (0.45) ADAM17POLBGAAKMT2AMEN1
SCHEMBL31298892 0.81 KDM4E (0.47) ADAM17POLBALDH1A1GAAKMT2A
SCHEMBL20773874 0.81 PARK7 (0.50) ADAM17POLBGAAKMT2AMEN1
SCHEMBL31039203 0.81 ADAM17 (0.46) ADAM17POLBGAAKMT2AMEN1
SCHEMBL29507053 0.81 PARK7 (0.50) ADAM17POLBGAAKMT2AMEN1
SCHEMBL28242054 0.81 ADAM17 (0.46) ADAM17POLBGAAKMT2AMEN1

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
WO-2004014365-A1 PHTHALIMIDE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed