SCHEMBL3685473

SCHEMBL3685473

O=C(O)CCc1ccc(C(=O)c2ccccc2)c(-c2ccc3ccccc3c2)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.55
PLA2G2A P14555 3/20 0.54
PLA2G10 O15496 2/20 0.54
SLCO1B1 Q9Y6L6 1/20 0.54
CYP1A2 P05177 2/20 0.51
CCNC P24863 1/20 0.50
CDK8 P49336 1/20 0.50
PDPK1 O15530 1/20 0.48
FFAR1 O14842 4/20 0.47
SRD5A2 P31213 1/20 0.45
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL3686315 0.87 CCNC (0.53) FFAR4PLA2G2APLA2G10SLCO1B1CYP1A2
SCHEMBL3683679 0.82 FFAR4 (0.60) FFAR4PLA2G2APLA2G10SLCO1B1CYP1A2
SCHEMBL3680372 0.81 FFAR4 (0.56) FFAR4PLA2G2APLA2G10SLCO1B1CYP1A2
SCHEMBL8451511 0.78 FFAR1 (0.71) FFAR4CYP1A2CCNCCDK8FFAR1
SCHEMBL3684268 0.78 FFAR4 (0.50) FFAR4PLA2G2APLA2G10SLCO1B1CYP1A2
SCHEMBL1217683 0.78 CYP1A2 (0.80) FFAR4CYP1A2PDPK1FFAR1CYP2D6
SCHEMBL30403190 0.78 CYP1A2 (0.80) FFAR4CYP1A2PDPK1FFAR1CYP2D6
SCHEMBL3683148 0.78 FFAR4 (0.61) FFAR4CYP1A2CCNCCDK8FFAR1
SCHEMBL3882947 0.78 FFAR4 (0.80) FFAR4CYP1A2CCNCCDK8FFAR1
Hydrochloric Acid SCHEMBL27401796 0.76 CYP1A2 (0.77) FFAR4CYP1A2PDPK1FFAR1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048893-A1 Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-02-25 US disclosed
US-20090062530-A1 Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-03-05 US disclosed
US-7470807-B2 Suppress production of both prostaglandins and leukotrienes and have reduced side effects; treatment of various inflammatory diseases, autoimmune diseases, allergic diseases, pain and fibrosis; for example, methyl 3-[3-acetylamino-4-cyclopentyloxy-5-(naphthalen-2-yl)phenyl]propionate ASAHI KASEI PHARMA CORPORATION (JP) 2008-12-30 US disclosed
US-20070213333-A1 Substituted arylalkanoic acid derivatives and use thereof ASAHI KASEI PHAMA CORPORATION (JP) 2007-09-13 US disclosed
EP-1660427-A4 SUBSTITUTED ARYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2006-12-20 EP disclosed
EP-1660427-A1 SUBSTITUTED ARYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2006-05-31 EP disclosed
WO-2005016862-A1 SUBSTITUTED ARYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORPORATION (JP) 2005-02-24 WO 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 (3 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-20100048893-A1 Substituted arylalkanoic acid derivatives and use thereof CYSLTR1, CYSLTR2, LTB4R2 FFAR4 35/4885PLA2G2A 596/4885PLA2G10 684/4885
US-20070213333-A1 Substituted arylalkanoic acid derivatives and use thereof CYSLTR1, CYSLTR2, LTB4R2 FFAR4 35/4885PLA2G2A 596/4885PLA2G10 684/4885
US-20090062530-A1 Substituted arylalkanoic acid derivatives and use thereof CYSLTR1, CYSLTR2, LTB4R2 FFAR4 35/4885PLA2G2A 596/4885PLA2G10 684/4885

“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.