SCHEMBL27635587

SCHEMBL27635587

CS(=O)(=O)Oc1cccc(OCc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.63
MAOA P21397 1/20 0.54
NR4A2 P43354 1/20 0.54
BCHE P06276 2/20 0.51
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
NPC1 O15118 1/20 0.51
AR P10275 1/20 0.51
HPGD P15428 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MGLL Q99685 1/20 0.51
GRM5 P41594 1/20 0.49
CCNB2 O95067 1/20 0.49
CDK1 P06493 1/20 0.49
CDK4 P11802 1/20 0.49
CCNB1 P14635 1/20 0.49
CCND1 P24385 1/20 0.49
CCNB3 Q8WWL7 1/20 0.49
SMPD1 P17405 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
SCHEMBL31487931 1.00 MAOB (0.63) MAOBMAOANR4A2BCHECYP4F2
SCHEMBL31487932 0.98 MAOB (0.61) MAOBMAOANR4A2BCHECYP4F2
SCHEMBL2004893 0.85 AR (0.64) MAOBMAOANR4A2BCHENPC1
SCHEMBL27406081 0.84 AR (0.49) MAOBNPC1ARHPGDRAB9A
SCHEMBL2617478 0.83 MAOB (0.57) MAOBMAOANR4A2BCHECYP4F2
SCHEMBL1268719 0.82 MAOB (0.81) MAOBMAOANR4A2BCHECYP4F2
SCHEMBL28182081 0.81 MAOB (0.79) MAOBMAOANR4A2BCHECYP4F2
SCHEMBL3838916 0.80 CA2 (0.60) HPGD
SCHEMBL5184334 0.79 LMNA (0.69) MAOBNR4A2BCHENPC1AR
SCHEMBL6761017 0.79 MGLL (0.44) MAOBBCHECYP4F2CYP4A11MGLL

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
CN-1835917-A Therapeutic agents ASTRAZENECA AB (SE) 2006-09-20 CN disclosed