Sugi Predict

Sugi Predict / Compounds / SCHEMBL8477440

SCHEMBL8477440

SCHEMBL8477440

CC(=O)Oc1ccc2c(c1)CCC(c1ccc(Cl)c(OC(C)=O)c1)=C2C(=O)c1ccc(OCCN2CCCCC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 13/20 0.68
▸ ESR2 Q92731 11/20 0.68
▸ PSMB1 P20618 1/20 0.47
▸ PSMB5 P28074 1/20 0.47
▸ PSMB2 P49721 1/20 0.47
▸ HRH3 Q9Y5N1 2/20 0.46
▸ EBP Q15125 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.46
▸ SRC P12931 1/20 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
SCHEMBL8472430 0.88 ESR1 (0.71) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8476709 0.85 ESR1 (0.67) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL7111316 0.85 ESR1 (0.69) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL7107810 0.84 ESR1 (0.70) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL7112974 0.84 ESR1 (0.84) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL3863139 0.82 ESR1 (0.78) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL13897604 0.82 ESR1 (0.78) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL8476547 0.82 ESR1 (0.68) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL7105785 0.82 ESR1 (0.67) ESR1ESR2PSMB1PSMB5PSMB2
SCHEMBL11186217 0.81 ESR1 (0.77) 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