SCHEMBL9768420

SCHEMBL9768420

CN(C)CCOc1ccc2c(c1)[nH]c(=O)c1c3ccccc3oc21

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.50
SIGMAR1 Q99720 3/20 0.49
TNKS O95271 2/20 0.47
CSF1R P07333 3/20 0.46
MAOA P21397 1/20 0.45
XDH P47989 1/20 0.44
HTT P42858 1/20 0.44
BCHE P06276 3/20 0.44
ACHE P22303 2/20 0.44
NUAK1 O60285 1/20 0.43

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
SCHEMBL9768415 0.90 XDH (0.55) PARP1SIGMAR1XDHBCHEACHE
SCHEMBL10668875 0.85 KCNA3 (0.44) XDHBCHEACHE
SCHEMBL10338976 0.84 ALDH1A1 (0.41) MAOAXDHHTT
SCHEMBL9768407 0.83 RAD52 (0.46) HTT
SCHEMBL9768404 0.81 XDH (0.56) PARP1XDHBCHEACHE
SCHEMBL10431239 0.80 CSF1R (0.47) TNKSCSF1RMAOAHTT
SCHEMBL9781524 0.80 KMT2A (0.42) HTTBCHEACHE
SCHEMBL9768419 0.79 MAOB (0.59) PARP1SIGMAR1MAOAXDHBCHE
SCHEMBL10614432 0.79 ALDH1A1 (0.45) MAOAHTT
SCHEMBL9768410 0.79 ALDH1A1 (0.42) XDHHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2142793-A None JP disclosed
US-5073553-A Treatment or prevention of osteoporosis KISSEI PHARMACEUTICAL CO., LTD. (JP) 1991-12-17 US disclosed
JP-H02142793-A NOVEL BENZOFUROQUINOLINE DERIVATIVE KISSEI PHARMACEUT CO LTD 1990-05-31 JP disclosed
EP-0370760-A2 Benzofuro[3,2-c]quinoline compounds Kissei Pharmaceutical Co., Ltd. (JP) 1990-05-30 EP disclosed