SCHEMBL6963489

SCHEMBL6963489

COc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 18/20 1.00
▸ CYSLTR1 Q9Y271 18/20 1.00
▸ GPBAR1 Q8TDU6 1/20 0.61

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
SCHEMBL6963495 1.00 CYSLTR2 (1.00) CYSLTR2CYSLTR1GPBAR1
Hydrochloric Acid SCHEMBL6970838 0.90 CYSLTR1 (0.82) CYSLTR2CYSLTR1GPBAR1
Hydrochloric Acid SCHEMBL6970832 0.90 CYSLTR1 (0.82) CYSLTR2CYSLTR1GPBAR1
SCHEMBL8191506 0.90 CYSLTR1 (0.86) CYSLTR2CYSLTR1GPBAR1
Hydrochloric Acid SCHEMBL6957818 0.90 CYSLTR1 (0.85) CYSLTR2CYSLTR1GPBAR1
SCHEMBL6177481 0.88 CYSLTR2 (1.00) CYSLTR2CYSLTR1GPBAR1
SCHEMBL6176975 0.88 CYSLTR2 (1.00) CYSLTR2CYSLTR1GPBAR1
SCHEMBL6968148 0.86 CYSLTR2 (1.00) CYSLTR2CYSLTR1GPBAR1
SCHEMBL6968142 0.86 CYSLTR2 (1.00) CYSLTR2CYSLTR1GPBAR1
SCHEMBL30383173 0.86 CYSLTR2 (1.00) CYSLTR2CYSLTR1GPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0902007-B1 CHALCONE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2003-11-05 — — EP disclosed
EP-0902007-A1 CHALCONE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO. LTD. (JP) 1999-03-17 — — EP disclosed
Send feedback