SCHEMBL11258232

SCHEMBL11258232

COC(=O)C1=CC=CC(C=O)(OC)C1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.32
LMNA P02545 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
THRB P10828 1/20 0.31
CHRM1 P11229 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BLM P54132 1/20 0.30
MCOLN3 Q8TDD5 1/20 0.30

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
SCHEMBL28466983 0.77 CHRM3 (0.35) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL28881873 0.76 CHRM3 (0.34) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL30163541 0.73
SCHEMBL11262229 0.73 CHRM3 (0.33) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL67176 0.72 CHRM3 (0.34) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL21693727 0.71 CHRM3 (0.33) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL7041565 0.70 CHRM3 (0.33) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL8125370 0.70 CHRM3 (0.33) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL3446589 0.70 CHRM3 (0.33) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL4939750 0.68 NPC1 (0.33) LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4341906-A ANALGESICS PFIZER INC. (US) 1982-07-27 US disclosed
US-4310669-A TETRALONE PFIZER INC. (US) 1982-01-12 US disclosed
US-4310529-A ANALGESICS PFIZER INC. (US) 1982-01-12 US disclosed
US-4310668-A Intermediates to 1,9-dihydroxyoctahydrophenanthrenes PFIZER INC. (US) 1982-01-12 US disclosed
US-4270005-A ANALGESICS PFIZER INC. (US) 1981-05-26 US disclosed
US-4268523-A ANALGESICS PFIZER INC. (US) 1981-05-19 US disclosed
US-4268692-A ANALGESICS PFIZER INC. (US) 1981-05-19 US disclosed
US-4237133-A ANALGESICS PFIZER INC. (US) 1980-12-02 US disclosed
US-4235913-A ANALGESICS, TRANQUILIZERS PFIZER INC. (US) 1980-11-25 US disclosed
US-4188495-A 1,9-Dihydroxyoctahydrophenanthrenes and intermediates therefor PFIZER INC. (US) 1980-02-12 US disclosed
US-4165323-A ANALGESICS, TRANQUILIZERS PFIZER INC. (US) 1979-08-21 US disclosed
US-4118559-A CNS AGENTS, ANALGESICS, TRANQUILIZERS PFIZER INC. (US) 1978-10-03 US disclosed