SCHEMBL14047367

SCHEMBL14047367

Oc1ccc([C@H]2Oc3ccc(O)cc3[C@H]3CCCC[C@H]32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 20/20 1.00
ESR1 P03372 19/20 1.00

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
SCHEMBL14514709 0.99 ESR2 (1.00) ESR2ESR1
Erteberel SCHEMBL14102412 0.97 ESR2 (1.00) ESR2ESR1
Erteberel SCHEMBL14514726 0.97 ESR2 (1.00) ESR2ESR1
Erteberel SCHEMBL14534968 0.97 ESR2 (1.00) ESR2ESR1
Erteberel SCHEMBL14102383 0.97 ESR2 (1.00) ESR2ESR1
Erteberel SCHEMBL14514704 0.97 ESR2 (1.00) ESR2ESR1
SCHEMBL14514618 0.92 ESR2 (0.85) ESR2ESR1
SCHEMBL14514611 0.91 ESR2 (0.85) ESR2ESR1
SCHEMBL14514763 0.89 ESR2 (0.85) ESR2ESR1
SCHEMBL14514616 0.89 ESR2 (0.85) ESR2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1790644-A1 Substituted benzopyrans as selective estrogen receptor-beta agonists ELI LILLY AND COMPANY (US) 2007-05-30 EP disclosed
EP-1448544-B1 SUBSTITUTED BENZOPYRANS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS LILLY CO ELI (US) 2007-05-16 EP disclosed
US-7217734-B2 Substituted benzopyrans as selective estrogen receptor-beta agonists ELI LILLY AND COMPANY (US) 2007-05-15 US disclosed
US-7217734-B2 Substituted benzopyrans as selective estrogen receptor-beta agonists ELI LILLY AND COMPANY (US) 2007-05-15 US disclosed