SCHEMBL1829682

SCHEMBL1829682

CCOC(=O)C(NC(=O)c1cccc(F)c1)C(=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
POLB P06746 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
HDAC1 Q13547 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
ALDH1A1 P00352 2/20 0.50
GAA P10253 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 1/20 0.49
KDM4E B2RXH2 2/20 0.48
KCNK3 O14649 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48
CTSL P07711 1/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
GPR139 Q6DWJ6 1/20 0.47
GFER P55789 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47

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
SCHEMBL1828342 0.85 TAS1R3 (0.62) SMN1; SMN2POLBHDAC6ALDH1A1NPC1
SCHEMBL5520763 0.83 HDAC1 (0.50) LMNASMN1; SMN2POLBTDP1HDAC1
SCHEMBL1339677 0.82 LMNA (0.48) LMNASMN1; SMN2POLBTDP1HDAC1
SCHEMBL655688 0.82 ALDH1A1 (0.56) LMNASMN1; SMN2HDAC1ALDH1A1GAA
SCHEMBL5784044 0.82 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL3117893 0.81 ITGB2 (0.48) SMN1; SMN2NPC1RAB9AKDM4EMEN1
SCHEMBL5784569 0.80 HDAC1 (0.56) LMNAHDAC1HDAC6ALDH1A1TAS1R3
SCHEMBL13702132 0.80 NPSR1 (0.64) LMNASMN1; SMN2HDAC1HDAC6ALDH1A1
SCHEMBL29518963 0.80 NPSR1 (0.64) LMNASMN1; SMN2HDAC1HDAC6ALDH1A1
SCHEMBL27881880 0.79 TAS1R3 (0.58) SMN1; SMN2POLBHDAC6ALDH1A1GAA

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 LMNA 4492/4885SMN1; SMN2 2304/4885POLB 1711/4885

“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.