SCHEMBL9601014

SCHEMBL9601014

Cc1cc(-c2cccc(Cl)c2CN)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.46
TAAR1 Q96RJ0 2/20 0.42
PTGS2 P35354 5/20 0.40
PTGS1 P23219 3/20 0.40
DPP4 P27487 1/20 0.39
CHRNA7 P36544 1/20 0.38
PKM P14618 1/20 0.38
HTR7 P34969 1/20 0.37
MAOB P27338 1/20 0.36

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
SCHEMBL9602073 0.79 PTGS2 (0.42) CD274PTGS2PTGS1
SCHEMBL5423580 0.74 GRIA1 (0.44) PTGS2PTGS1CHRNA7
SCHEMBL9602188 0.74 PTGS2 (0.43) CD274PTGS2PTGS1
SCHEMBL10742738 0.73 MEN1 (0.46) PTGS2PTGS1CHRNA7
SCHEMBL28742887 0.72 TNKS2 (0.56) DPP4
SCHEMBL5584235 0.72 KMT2A (0.50) PKM
SCHEMBL30507311 0.71 PTGS2 (0.47) PTGS2PTGS1CHRNA7HTR7
SCHEMBL31378249 0.71 PTGS2 (0.46) CD274PTGS2PTGS1CHRNA7HTR7
SCHEMBL21317781 0.71 NOS3 (0.41) CD274PTGS2PTGS1DPP4HTR7
SCHEMBL28155203 0.71 TP53 (0.38) CD274TAAR1DPP4MAOB

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-0318181-B1 N-(Biphenylmethyl)-3-hydroxyglutaramic acids and derivatives as hypocholesterolemic agents PFIZER (US) 1993-06-16 EP disclosed
US-5169976-A N-(biphenylmethyl)-3-hydroxyglutaramic acid and derivatives as hypocholesterolemic agents PFIZER INC. (US) 1992-12-08 US disclosed
EP-0318181-A2 N-(Biphenylmethyl)-3-hydroxyglutaramic acids and derivatives as hypocholesterolemic agents PFIZER INC. (US) 1989-05-31 EP disclosed