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SCHEMBL8475241

SCHEMBL8475241

COc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(-c3ccc(Cl)cc3OC)ccc2c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 16/20 0.57
▸ ESR2 Q92731 15/20 0.57
▸ PSMB1 P20618 1/20 0.51
▸ PSMB5 P28074 1/20 0.51
▸ PSMB2 P49721 1/20 0.51
▸ FLT3 P36888 1/20 0.48
▸ KCNA5 P22460 1/20 0.48
▸ DRD3 P35462 1/20 0.48
▸ DRD2 P14416 1/20 0.48

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
SCHEMBL5430797 0.90 ESR1 (0.58) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8473947 0.90 ESR1 (0.58) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL1359583 0.88 ESR1 (0.57) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8472729 0.86 ESR1 (0.58) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL1358515 0.86 ESR1 (0.63) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8473855 0.86 ESR1 (0.55) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8474177 0.86 ESR1 (0.57) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL1359436 0.86 ESR1 (0.56) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8478108 0.85 ESR1 (0.61) ESR1ESR2DRD3DRD2
SCHEMBL5422551 0.85 ESR1 (0.58) 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