SCHEMBL14224950

SCHEMBL14224950

CCOc1ccc(C)cc1NC(=O)C(=O)Nc1ccccc1CC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.52
KCNMA1 Q12791 1/20 0.51
MAPT P10636 6/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MRGPRX1 Q96LB2 1/20 0.49
GAA P10253 1/20 0.49
LMNA P02545 2/20 0.48
TSHR P16473 2/20 0.48
TP53 P04637 2/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47

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
SCHEMBL14274490 0.89 CYP1A2 (0.50) KMT2AMEN1SMN1; SMN2KCNMA1MAPT
SCHEMBL29365765 0.86 GAA (0.65) KMT2AMEN1SMN1; SMN2MAPTGAA
SCHEMBL453995 0.86 GAA (0.65) KMT2AMEN1SMN1; SMN2MAPTGAA
SCHEMBL29365745 0.84 CYP2C19 (0.52) KMT2AMEN1SMN1; SMN2MAPTNPSR1
SCHEMBL30298079 0.84 CYP2C19 (0.52) KMT2AMEN1SMN1; SMN2MAPTNPSR1
SCHEMBL208693 0.84 CYP2C19 (0.52) KMT2AMEN1SMN1; SMN2MAPTNPSR1
SCHEMBL30182959 0.84 CYP2C19 (0.52) KMT2AMEN1SMN1; SMN2MAPTNPSR1
SCHEMBL20506718 0.82 POLB (0.48) KMT2AMEN1SMN1; SMN2MAPTGAA
SCHEMBL14098226 0.79 CYP1A2 (0.65) KMT2AMEN1SMN1; SMN2KCNMA1MAPT
SCHEMBL8110954 0.78 GAA (0.75) KMT2AMEN1SMN1; SMN2GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020182709-A1 SHAPED ARTIFICIAL POLYMER ARTICLES BASF SE (DE) 2020-09-17 WO disclosed
US-20120316274-A1 WEATHER RESISTANT VINYL CHLORIDE RESIN COMPOSITION ADEKA CORPORATION (JP) 2012-12-13 US disclosed
US-7332105-B2 Synergistic UV absorber combination CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-02-19 US disclosed