SCHEMBL9201225

SCHEMBL9201225

CC1(C)Cc2cc(Cl)cc(OC(=O)O)c2O1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 10/20 0.47
LMNA P02545 1/20 0.45
HTR2A P28223 1/20 0.44
PKM P14618 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CTSA P10619 1/20 0.38

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
SCHEMBL4752981 0.89 LMNA (0.45) FFAR4LMNAHTR2APKMNPSR1
SCHEMBL10995835 0.85 LMNA (0.64) FFAR4LMNAHTR2APKMNPSR1
SCHEMBL2432528 0.78 FFAR4 (0.49) FFAR4LMNAHTR2APKMNPSR1
SCHEMBL29015941 0.78 HTR2A (0.48) FFAR4LMNAHTR2APKMNPSR1
Hydrochloric Acid SCHEMBL7626508 0.77 FFAR4 (0.48) FFAR4LMNAHTR2APKMNPSR1
SCHEMBL18649397 0.77 HTR2A (0.49) FFAR4LMNAHTR2A
SCHEMBL10816709 0.77 LMNA (0.72) LMNA
SCHEMBL21517961 0.76 FFAR4 (0.48) FFAR4HTR2A
SCHEMBL7626504 0.75 HTR2A (0.50) FFAR4LMNAHTR2APKMNPSR1
SCHEMBL220746 0.75 PKM (0.50) FFAR4LMNAHTR2APKMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0307172-B1 Improvements in or relating to specific 5-HT3 antagonists LILLY CO ELI (US) 1995-10-11 EP claimed