SCHEMBL3668051

SCHEMBL3668051

COCCOc1cccc(CCC(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.60
PPARD Q03181 1/20 0.52
FFAR4 Q5NUL3 2/20 0.51
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
PPARG P37231 1/20 0.50
PPARA Q07869 1/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
LTB4R Q15722 1/20 0.49
CYP2D6 P10635 2/20 0.49

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
SCHEMBL65681 0.88 TDP1 (0.54) FFAR1KDM4EALDH1A1GAAPPARG
SCHEMBL1206748 0.87 LMNA (0.68) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL1206101 0.85 PPARA (0.64) FFAR1PPARGPPARALMNAL3MBTL1
SCHEMBL6063728 0.85 FFAR1 (0.58) FFAR1PPARDFFAR4PPARA
SCHEMBL18301907 0.85 PLA2G4B (0.59) FFAR1PPARDKDM4EALDH1A1GAA
SCHEMBL17413767 0.85 FFAR1 (0.71) FFAR1PPARDFFAR4
SCHEMBL2741520 0.84 LMNA (0.54) FFAR1FFAR4KDM4EALDH1A1LMNA
SCHEMBL17413763 0.84 FFAR1 (0.69) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL1205963 0.83 FFAR1 (0.61) FFAR1PPARDFFAR4PPARGPPARA
SCHEMBL25456542 0.83 PPARA (0.69) FFAR1PPARGPPARACYP2D6

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
US-7812038-B2 Carboxylic acid derivatives that inhibit the binding of integrins to their receptors ENCYSIVE PHARMACEUTICALS, INC. (US) 2010-10-12 US disclosed
US-20060276476-A1 Carboxylic acid derivatives that inhibit the binding of integrins to their receptors BIEDIGER RONALD J 2006-12-07 US disclosed
US-6972296-B2 Carboxylic acid derivatives that inhibit the binding of integrins to their receptors ENCYSIVE PHARMACEUTICALS INC. (US) 2005-12-06 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-20060276476-A1 Carboxylic acid derivatives that inhibit the binding of integrins to their receptors VCAM1, ICAM1, ITGA1 FFAR1 74/4885PPARD 609/4885FFAR4 107/4885

“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.