SCHEMBL1829008

SCHEMBL1829008

CCOC(=O)C(NC(=O)c1cc(F)ccc1Cl)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
ITGB7 P26010 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
ANO1 Q5XXA6 1/20 0.39
CTSL P07711 1/20 0.39
TSHR P16473 2/20 0.39
NR3C2 P08235 1/20 0.39
P2RX7 Q99572 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL18896189 0.81 KCNA3 (0.47) ITGB1ITGA4ITGB7ANO1CTSL
SCHEMBL1829010 0.79 ITGB1 (0.40) ITGB1ITGA4ITGB7TAS1R3TAS1R1
SCHEMBL4650983 0.79 EPHX2 (0.47) TSHRALDH1A1
SCHEMBL18896227 0.79 ALDH1A1 (0.52) TAS1R3TAS1R1ANO1CTSLSMN1; SMN2
Methylamine SCHEMBL7262148 0.79 KCNA3 (0.45) ITGB1ITGA4ITGB7ANO1CTSL
SCHEMBL11801981 0.78 CYP4F2 (0.63) CYP4F2CYP4A11TSHRNR3C2SMN1; SMN2
SCHEMBL655688 0.77 ALDH1A1 (0.56) SMN1; SMN2MAPTALDH1A1
SCHEMBL14740250 0.77 CYP4F2 (0.45) CYP4F2CYP4A11TSHRNR3C2SMN1; SMN2
SCHEMBL23430714 0.75 HSD17B10 (0.49) ANO1TSHRP2RX7ALDH1A1
SCHEMBL1829682 0.75 LMNA (0.58) TAS1R3TAS1R1CTSLSMN1; SMN2ALDH1A1

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-8735387-B2 Oxazolopyrimidines as Edg-1 receptor agonists SANOFI (FR) 2014-05-27 US disclosed
EP-2583720-A1 Oxazolopyrimidines as Edg-1 receptor agonists SANOFI (FR) 2013-04-24 EP disclosed
EP-2318415-B1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS SANOFI SA (FR) 2013-02-20 EP disclosed
CN-102159582-A Oxazolopyrimidines as edg-1 receptor agonists SANOFI AVENTIS 2011-08-17 CN disclosed
US-20110190490-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS SANOFI-AVENTIS (FR) 2011-08-04 US disclosed
EP-2318415-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS Sanofi-Aventis (FR) 2011-05-11 EP disclosed
WO-2010006704-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS SANOFI-AVENTIS (FR) 2010-01-21 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 (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-20110190490-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS EDNRA, OXGR1, EDF1 CYP4F2 866/4885CYP4A11 2209/4885ITGB1 1086/4885

“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.