SCHEMBL2222996

SCHEMBL2222996

Cc1cc(-c2nc3cnc(OC4CCCC4)nc3o2)cc(C)c1OCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 6/20 0.62
FFAR4 Q5NUL3 2/20 0.39
PPARD Q03181 2/20 0.36
PPARA Q07869 1/20 0.36
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
PTPN1 P18031 1/20 0.34
ACACB O00763 1/20 0.34
S1PR3 Q99500 5/20 0.33
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
ACSL1 P33121 1/20 0.32

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
SCHEMBL14797188 0.85 S1PR1 (0.60) S1PR1PPARDPPARAPTPN1ACACB
SCHEMBL2223368 0.81 S1PR1 (0.83) S1PR1PPARDPPARAPTPN1
SCHEMBL14796997 0.80 S1PR1 (0.62) S1PR1PPARDPPARATHRATHRB
SCHEMBL2223316 0.80 S1PR1 (0.75) S1PR1PPARDPPARATHRBPTPN1
SCHEMBL2146260 0.80 S1PR1 (0.43) S1PR1FFAR4PPARDPPARATHRA
SCHEMBL14797071 0.80 S1PR1 (0.71) S1PR1PPARDPPARAPTPN1CSNK2A2
SCHEMBL14797136 0.80 S1PR1 (0.71) S1PR1THRB
SCHEMBL14797179 0.79 S1PR1 (0.79) S1PR1PPARDPPARAPTPN1
SCHEMBL2273845 0.79 S1PR1 (0.70) S1PR1PPARA
SCHEMBL2222062 0.79 S1PR1 (0.82) S1PR1PPARDPPARAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846692-B2 Carboxylic acid derivatives having a 2,5-substituted oxazolopyrimidine ring SANOFI (FR) 2014-09-30 US disclosed
EP-2523962-B1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI SA (FR) 2013-11-27 EP disclosed
US-20130079358-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2013-03-28 US disclosed
EP-2523962-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP disclosed
WO-2011086079-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 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-20130079358-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING OXGR1, EDNRA, EDF1 S1PR1 129/4885FFAR4 61/4885PPARD 370/4885

“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.