SCHEMBL11036014

SCHEMBL11036014

CNC(=O)COc1ccc(Cl)cc1C(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
GAA P10253 1/20 0.63
LMNA P02545 1/20 0.63
TP53 P04637 4/20 0.62
ALDH1A1 P00352 2/20 0.57
THRB P10828 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
PTGDR2 Q9Y5Y4 2/20 0.53
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL21067312 0.87 TP53 (0.66) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL27533944 0.87 SMN1; SMN2 (0.60) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL12798165 0.86 MAPT (0.56) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL8398940 0.86 PTGDR2 (0.70) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL5627237 0.85 PTGDR2 (0.57) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL13996745 0.85 MAPT (0.70) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL14419325 0.82 HPGD (0.58) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL5624016 0.81 TP53 (0.59) MAPTSMN1; SMN2GAALMNATP53
SCHEMBL25894308 0.81 NPC1 (0.71) SMN1; SMN2LMNATP53ALDH1A1TSHR
SCHEMBL14419384 0.81 SMN1; SMN2 (0.60) MAPTSMN1; SMN2GAALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59181246-A None JP disclosed
JP-S59181246-A BENZOPHENONE DERIVATIVE CHUGAI PHARMACEUT CO LTD 1984-10-15 JP disclosed