SCHEMBL3667217

SCHEMBL3667217

CCCOc1ccc(CCC(=O)O)cc1OCCC

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
FFAR4 Q5NUL3 5/20 0.52
FFAR1 O14842 4/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
PPARG P37231 2/20 0.49
MAPT P10636 1/20 0.49
HSD17B10 Q99714 1/20 0.49
S1PR1 P21453 1/20 0.48
PPARA Q07869 1/20 0.48
AKR1C3 P42330 1/20 0.47
PTGES O14684 1/20 0.47
ALOX5 P09917 1/20 0.47
LTB4R Q15722 1/20 0.47
BIRC5 O15392 1/20 0.47
RXRA P19793 1/20 0.46

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
SCHEMBL3693650 0.93 LMNA (0.60) LMNAL3MBTL1FFAR4FFAR1HDAC1
SCHEMBL3667760 0.92 LMNA (0.59) LMNAL3MBTL1FFAR4FFAR1HDAC1
SCHEMBL8984884 0.89 LMNA (0.63) LMNAL3MBTL1FFAR4FFAR1HDAC1
SCHEMBL10467868 0.89 HDAC1 (0.52) LMNAL3MBTL1HDAC1HDAC2PPARG
SCHEMBL2840795 0.87 FFAR4 (0.55) LMNAL3MBTL1FFAR4FFAR1HDAC1
SCHEMBL6693290 0.87 LMNA (0.60) LMNAL3MBTL1FFAR4FFAR1HDAC1
SCHEMBL3974023 0.86 FFAR4 (0.51) LMNAL3MBTL1FFAR4FFAR1HDAC1
SCHEMBL30159686 0.84 ALDH1A1 (0.53) LMNAL3MBTL1PPARGMAPTHSD17B10
SCHEMBL28669480 0.84 ALDH1A1 (0.53) LMNAL3MBTL1PPARGMAPTHSD17B10
SCHEMBL9679355 0.83 RXRA (0.63) LMNAL3MBTL1FFAR4FFAR1PPARG

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 LMNA 1820/4885L3MBTL1 3947/4885FFAR4 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.