SCHEMBL8475375

SCHEMBL8475375

CCOC(=O)c1c(C(c2ccc(C)cc2)c2ccc(C)cc2)c2ccccc2n1CCN1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.50
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
CASP1 P29466 1/20 0.44
KLK7 P49862 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TP53 P04637 2/20 0.43
TSHR P16473 2/20 0.43
USP2 O75604 1/20 0.43
MAPK1 P28482 1/20 0.43
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
RAB9A P51151 1/20 0.43
CNR2 P34972 2/20 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
SCHEMBL8477374 0.99 PTGER4 (0.51) PTGER4SMN1; SMN2KDM4EALDH1A1POLB
SCHEMBL8475515 0.94 PTGER4 (0.51) PTGER4SMN1; SMN2KDM4EALDH1A1POLB
SCHEMBL8473765 0.93 PTGER4 (0.52) PTGER4SMN1; SMN2KDM4EALDH1A1POLB
SCHEMBL8476475 0.91 CNR1 (0.49) KDM4EALDH1A1GAAHPGDCNR2
SCHEMBL8477133 0.88 PTGER4 (0.48) PTGER4KDM4EALDH1A1CNR2LMNA
SCHEMBL8474648 0.88 PTGER4 (0.48) PTGER4KDM4EALDH1A1CNR2LMNA
SCHEMBL8472201 0.88 KDM4E (0.47) PTGER4SMN1; SMN2KDM4EALDH1A1POLB
SCHEMBL8474563 0.87 LTA4H (0.50) PTGER4SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL8475107 0.86 KDM4E (0.45) PTGER4SMN1; SMN2KDM4EALDH1A1POLB
SCHEMBL8474896 0.85 EGFR (0.47) PTGER4SMN1; SMN2KDM4EALDH1A1RAB9A

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-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed