SCHEMBL9768419

SCHEMBL9768419

O=c1[nH]c2cc(OCCN3CCOCC3)ccc2c2oc3ccccc3c12

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.59
PDGFRB P09619 2/20 0.55
KDR P35968 2/20 0.55
FGFR1 P11362 1/20 0.55
MAOA P21397 1/20 0.50
PARP1 P09874 3/20 0.49
PDGFRA P16234 1/20 0.47
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
XDH P47989 3/20 0.47
CCR4 P51679 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
P2RY12 Q9H244 1/20 0.45
DRD2 P14416 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL9768404 0.92 XDH (0.56) MAOBPDGFRBKDRFGFR1PARP1
SCHEMBL9768406 0.84 SMN1; SMN2 (0.52) KDM4EALDH1A1MAPTHPGD
SCHEMBL10668875 0.81 KCNA3 (0.44) BCHEACHEXDHP2RY12ALDH1A1
SCHEMBL9768420 0.79 PARP1 (0.50) MAOAPARP1BCHEACHEXDH
SCHEMBL9768405 0.77 L3MBTL1 (0.52) KDM4EALDH1A1MAPTHPGD
SCHEMBL10338976 0.77 ALDH1A1 (0.41) MAOAXDHKDM4EALDH1A1MAPT
SCHEMBL9768415 0.77 XDH (0.55) PARP1BCHEACHEXDHSIGMAR1
SCHEMBL9768410 0.77 ALDH1A1 (0.42) FGFR1XDHKDM4EALDH1A1MAPT
SCHEMBL21676466 0.77 PARP1 (0.62) PDGFRBKDRFGFR1MAOAPARP1
Hydrochloric Acid SCHEMBL31070034 0.76 MAOA (0.69) PDGFRBMAOAPARP1PDGFRAKDM4E

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
US-5073553-A Treatment or prevention of osteoporosis KISSEI PHARMACEUTICAL CO., LTD. (JP) 1991-12-17 US disclosed
EP-0370760-A2 Benzofuro[3,2-c]quinoline compounds Kissei Pharmaceutical Co., Ltd. (JP) 1990-05-30 EP disclosed