SCHEMBL8477374

SCHEMBL8477374

CCOC(=O)c1c(C(c2ccc(C)cc2)c2ccc(C)cc2)c2ccccc2n1CCN1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.51
KDM4E B2RXH2 3/20 0.44
TP53 P04637 3/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 2/20 0.44
USP2 O75604 1/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
CASP1 P29466 1/20 0.43
KLK7 P49862 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ELANE P08246 1/20 0.42

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
SCHEMBL8475375 0.99 PTGER4 (0.50) PTGER4KDM4ETP53TSHRMAPK1
SCHEMBL8473765 0.94 PTGER4 (0.52) PTGER4KDM4ETSHRSMN1; SMN2ALDH1A1
SCHEMBL8475515 0.93 PTGER4 (0.51) PTGER4KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL8476475 0.92 CNR1 (0.49) KDM4EALDH1A1HPGDGAACNR2
SCHEMBL8474648 0.89 PTGER4 (0.48) PTGER4KDM4EALDH1A1CNR2LMNA
SCHEMBL8477133 0.89 PTGER4 (0.48) PTGER4KDM4EALDH1A1CNR2LMNA
SCHEMBL8474563 0.88 LTA4H (0.50) PTGER4KDM4ETP53MAPK1SMN1; SMN2
SCHEMBL8475107 0.87 KDM4E (0.45) PTGER4KDM4ETP53TSHRMAPK1
SCHEMBL8472201 0.86 KDM4E (0.47) PTGER4KDM4ETP53TSHRMAPK1
SCHEMBL8474896 0.86 EGFR (0.47) PTGER4KDM4ERAB9ASMN1; SMN2ALDH1A1

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