SCHEMBL923482

SCHEMBL923482

Nc1cc(CCC(=O)O)cc(-c2ccc3[nH]ncc3c2)c1OC1Cc2cccc(O)c2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.36
TRPA1 O75762 3/20 0.35
FFAR4 Q5NUL3 1/20 0.34
CPT2 P23786 1/20 0.34
CPT1A P50416 1/20 0.34
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
ROCK2 O75116 3/20 0.33
CYP3A4 P08684 2/20 0.33
CDC7 O00311 1/20 0.33
USP7 Q93009 1/20 0.33
TGFBR1 P36897 1/20 0.33
F11 P03951 1/20 0.33
GRIN2B Q13224 1/20 0.33
MAPK14 Q16539 1/20 0.33
AR P10275 1/20 0.33
CTNNB1 P35222 1/20 0.33
WNT3A P56704 1/20 0.33
DYRK3 O43781 1/20 0.33
CLK1 P49759 1/20 0.33

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
SCHEMBL925399 0.91 TRPA1 (0.40) FABP4TRPA1FFAR4CPT2CPT1A
SCHEMBL923645 0.91 TRPA1 (0.41) FABP4TRPA1FFAR4CPT2CPT1A
SCHEMBL922867 0.90 USP7 (0.36) FABP4TRPA1FFAR4CPT2CPT1A
SCHEMBL922985 0.90 ATR (0.38) FABP4TRPA1FFAR4ROCK2
SCHEMBL923783 0.88 PTGER1 (0.40) TRPA1FFAR4CPT2CPT1ABRD4
SCHEMBL924514 0.86 USP7 (0.38) FABP4TRPA1CPT2CPT1AROCK2
SCHEMBL923766 0.86 TRPA1 (0.39) FABP4TRPA1FFAR4CPT2CPT1A
SCHEMBL923774 0.85 ABCB1 (0.42) TRPA1CPT2CPT1AROCK2MAPK14
SCHEMBL923053 0.84 TRPA1 (0.39) FABP4TRPA1FFAR4CPT2CPT1A
SCHEMBL923765 0.84 AR (0.38) TRPA1FFAR4BRD4CREBBPUSP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006225-B2 Stable pharmaceutical composition ASAHI KASEI PHARMA CORPORATION (JP) 2015-04-14 US disclosed
EP-2620431-A1 Novel crystals of substituted phenylalkanoic acid and production process Asahi Kasei Pharma Corporation (JP) 2013-07-31 EP disclosed
EP-2045244-B1 NOVEL CRYSTAL OF SUBSTITUTED PHENYLALKANOIC ACID AND PRODUCTION PROCESS ASAHI KASEI PHARMA CORP (JP) 2013-04-03 EP disclosed
US-7935720-B2 Crystal of substituted phenylalkanoic acid ester and process for producing the same ASAHI KASEI PHARMA CORPORATION (JP) 2011-05-03 US disclosed
US-20110021593-A1 NOVEL CRYSTAL OF SUBSTITUTED PHENYLALKANOIC ACID ESTER AND PROCESS FOR PRODUCING THE SAME SHODA MOTOSHI 2011-01-27 US disclosed
US-7838546-B2 Crystal of substituted phenylalkanoic acid ester and process for producing the same ASAHI KASEI PHARMA CORPORATION (JP) 2010-11-23 US disclosed
EP-2236135-A1 STABLE PHARMACEUTICAL COMPOSITION Asahi Kasei Pharma Corporation (JP) 2010-10-06 EP disclosed
US-20100234440-A1 NOVEL CRYSTAL OF SUBSTITUTED PHENYLALKANOIC ACID ESTER AND PROCESS FOR PRODUCING THE SAME SHODA MOTOSHI 2010-09-16 US disclosed
US-20100041725-A1 STABLE PHARMACEUTICAL COMPOSITION ASAHI KASEI PHARMA CORPORATION (JP) 2010-02-18 US disclosed
US-7560478-B2 Crystal forms of substituted phenylalkanoic acids and process for producing the same ASAHI KASEI PHARMA CORPORATION (JP) 2009-07-14 US disclosed
EP-2045244-A1 NOVEL CRYSTAL OF SUBSTITUTED PHENYLALKANOIC ACID AND PRODUCTION PROCESS Asahi Kasei Pharma Corporation (JP) 2009-04-08 EP disclosed
US-20080070967-A1 Novel crystal forms of substituted phenylalkanoic acids and process for producing the same ASAHI KASEI PHARMA CORPORATION (JP) 2008-03-20 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 (1 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-20100041725-A1 STABLE PHARMACEUTICAL COMPOSITION SLC5A1, SLC5A2, SLC2A9 FABP4 2375/4885TRPA1 2246/4885FFAR4 1679/4885

“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.