SCHEMBL7185405

SCHEMBL7185405

Cc1cc(NC(=O)Cc2ccccc2)ccc1N1CCCOC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.51
SMN1; SMN2 Q16637 4/20 0.47
POLB P06746 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 5/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 2/20 0.47
USP2 O75604 1/20 0.47
HPGD P15428 1/20 0.47
BLM P54132 1/20 0.47
NPC1 O15118 6/20 0.46
NR4A1 P22736 1/20 0.46
HTT P42858 1/20 0.46
NPY2R P49146 1/20 0.45
GAA P10253 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL7150787 0.83 RAB9A (0.54) RAB9ASMN1; SMN2POLBCYP3A4CYP2C19
SCHEMBL6140496 0.83 RAB9A (0.51) RAB9ASMN1; SMN2POLBCYP3A4CYP2C19
SCHEMBL7153206 0.82 RAB9A (0.53) RAB9ASMN1; SMN2POLBCYP3A4CYP2C19
SCHEMBL7147258 0.80 NPC1 (0.49) RAB9ASMN1; SMN2CYP3A4ALDH1A1KMT2A
SCHEMBL5165701 0.77 F10 (0.44)
SCHEMBL8270932 0.77 HTR1A (0.34) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL6140081 0.76 LMNA (0.47) RAB9ASMN1; SMN2POLBCYP3A4CYP2C19
SCHEMBL6918329 0.73 POLB (0.67) RAB9ASMN1; SMN2POLBCYP3A4CYP2C19
SCHEMBL11317939 0.72 POLB (0.60) RAB9ASMN1; SMN2POLBALDH1A1KDM4E
SCHEMBL7154949 0.72 POLB (0.50) RAB9ASMN1; SMN2POLBCYP3A4CYP2C19

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
EP-1351938-A1 PHENYL DERIVATIVES MERCK PATENT GmbH (DE) 2003-10-15 EP claimed
WO-2002057236-A1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2002-07-25 WO claimed