SCHEMBL8966205

SCHEMBL8966205

Oc1ccc2c3c(ccc2c1)-c1ccccc1C3c1ccc(OCCN2CCCCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 18/20 1.00
ESR2 Q92731 18/20 1.00
HRH3 Q9Y5N1 2/20 0.54

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
SCHEMBL7524349 0.94 ESR1 (0.88) ESR1ESR2HRH3
SCHEMBL8966114 0.93 ESR1 (1.00) ESR1ESR2
SCHEMBL8610437 0.93 ESR1 (0.86) ESR1ESR2HRH3
SCHEMBL7524102 0.93 ESR1 (0.87) ESR1ESR2
Hydrochloric Acid SCHEMBL7523890 0.92 ESR1 (0.86) ESR1ESR2
SCHEMBL7525411 0.92 ESR1 (0.85) ESR1ESR2
SCHEMBL8966130 0.90 ESR1 (0.86) ESR1ESR2
SCHEMBL8966174 0.89 ESR1 (0.80) ESR1ESR2HRH3
SCHEMBL7531774 0.89 ESR1 (0.80) ESR1ESR2HRH3
SCHEMBL7529579 0.88 ESR1 (0.80) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0524742-B1 Benzo(a)fluorene compounds LILLY CO ELI (US) 1996-02-28 EP disclosed
EP-0524742-A2 Benzo(a)fluorene compounds ELI LILLY AND COMPANY (US) 1993-01-27 EP disclosed
US-5147880-A Estrogenic and antiestrogenic activity ELI LILLY AND COMPANY (US) 1992-09-15 US disclosed