SCHEMBL7565855

SCHEMBL7565855

CCCC1CC(=CC(=O)Cl)c2cc(F)ccc21

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.34
AKR1B1 P15121 1/20 0.32
ACHE P22303 1/20 0.31
PPARG P37231 2/20 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
SCHEMBL7565845 1.00 FFAR4 (0.34) FFAR4AKR1B1ACHEPPARG
SCHEMBL7565851 1.00 FFAR4 (0.34) FFAR4AKR1B1ACHEPPARG
SCHEMBL7565999 0.90 ACHE (0.33) FFAR4ACHEPPARG
SCHEMBL7565997 0.90 ACHE (0.33) FFAR4ACHEPPARG
SCHEMBL7565987 0.90 ACHE (0.33) FFAR4ACHEPPARG
SCHEMBL7566360 0.89 TRPA1 (0.36) FFAR4AKR1B1ACHEPPARG
SCHEMBL7566372 0.89 TRPA1 (0.36) FFAR4AKR1B1ACHEPPARG
SCHEMBL7566366 0.89 TRPA1 (0.36) FFAR4AKR1B1ACHEPPARG
SCHEMBL8143490 0.88 MAOA (0.39) FFAR4AKR1B1ACHEPPARG
SCHEMBL8143488 0.88 MAOA (0.39) FFAR4AKR1B1ACHEPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0987248-B1 Amide derivatives and their therapeutic use WELLCOME FOUND (GB) 2002-09-04 EP disclosed
EP-0699180-B1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS WELLCOME FOUND (GB) 2000-11-22 EP disclosed
US-6124284-A REDUCED SIDE EFFECTS GLAXO WELLCOME INC. (US) 2000-09-26 US disclosed
EP-0987248-A1 Amide derivatives and their therapeutic use THE WELLCOME FOUNDATION LIMITED (GB) 2000-03-22 EP disclosed
US-5872118-A RELAXATION OF SKELETAL MUSCLE IN SPASTIC, HYPERTONIC AND HYPERKINETIC CONDITIONS GLAXO WELLCOME INC. (US) 1999-02-16 US disclosed
EP-0699180-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1996-03-06 EP disclosed
WO-1994026693-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-24 WO disclosed
WO-1994026692-A1 BICYCLIC AMIDE DERIVATIVES AND THEIR USE AS MUSCLE RELAXANTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-24 WO disclosed