SCHEMBL8477243

SCHEMBL8477243

COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(-c3cccc(OC(C)=O)c3)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 19/20 0.56
ESR2 Q92731 18/20 0.56
PSMB1 P20618 1/20 0.49
PSMB5 P28074 1/20 0.49
PSMB2 P49721 1/20 0.49

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
SCHEMBL8478697 1.00 ESR1 (0.56) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8478673 0.97 ESR1 (0.53) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL7107781 0.96 ESR1 (0.60) ESR1ESR2PSMB1PSMB5PSMB2
Hydrochloric Acid SCHEMBL7105337 0.95 ESR1 (0.60) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8582272 0.95 ESR1 (0.58) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8476695 0.92 GCGR (0.52) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8476393 0.91 KDM4E (0.56) ESR1ESR2
SCHEMBL8473117 0.91 ESR1 (0.62) ESR1ESR2
SCHEMBL8476813 0.90 ESR1 (0.63) ESR1ESR2
SCHEMBL8472976 0.90 GCGR (0.61) ESR1ESR2PSMB1PSMB5PSMB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958916-A FOR INHIBITING BONE LOSS OR BONE RESORPTION ELI LILLY AND COMPANY (US) 1999-09-28 US disclosed