SCHEMBL1052608

SCHEMBL1052608

FC(F)(F)c1ccc(-c2nc(CI)co2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
NOTUM Q6P988 1/20 0.43
LMNA P02545 2/20 0.40
THRB P10828 1/20 0.40
S1PR1 P21453 2/20 0.39
S1PR3 Q99500 1/20 0.39
KIF11 P52732 1/20 0.39
IKBKB O14920 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
NPC1 O15118 1/20 0.37
CASP3 P42574 2/20 0.37
MAOB P27338 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2C19 P33261 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
SCHEMBL6476484 0.84 PPARG (0.43) PPARGPPARANOTUMLMNATHRB
SCHEMBL5901540 0.84 PPARG (0.46) PPARGPPARANOTUMLMNATHRB
SCHEMBL1050007 0.82 NOTUM (0.51) NOTUMLMNANPC1CASP3MAOB
SCHEMBL2223682 0.81 LMNA (0.52) NOTUMLMNANPC1POLBHSD17B10
SCHEMBL4905721 0.81 PPARG (0.49) PPARGPPARANOTUMLMNATHRB
SCHEMBL4905908 0.81 MAOB (0.49) PPARGPPARANOTUMLMNATHRB
SCHEMBL16215610 0.81 PPARG (0.43) PPARGPPARANOTUMLMNATHRB
SCHEMBL1051604 0.80 NOTUM (0.47) PPARGPPARANOTUMS1PR1S1PR3
SCHEMBL1051422 0.78 HDAC1 (0.46) PPARGPPARANOTUM
SCHEMBL16579443 0.78 PPARG (0.45) PPARGPPARANOTUMLMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7872034-B2 Arylcycloalkyl-substituted alkanoic acid derivatives, processes for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-01-18 US disclosed
US-20080167354-A1 ARYLYCLOALKYL-SUBSTITUTED ALKANOIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-07-10 US disclosed
US-7335671-B2 Arylcycloalkyl-substituted alkanoic acid derivatives, processes for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-02-26 US disclosed
US-20040209920-A1 Arylcycloalkyl-substituted alkanoic acid derivatives, processes for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080167354-A1 ARYLYCLOALKYL-SUBSTITUTED ALKANOIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS GPR119, FFAR1, FFAR2 PPARG 43/4885PPARA 30/4885NOTUM 515/4885
US-20040209920-A1 Arylcycloalkyl-substituted alkanoic acid derivatives, processes for their preparation and their use as pharmaceuticals GPR119, FFAR1, FFAR2 PPARG 40/4885PPARA 30/4885NOTUM 568/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.