SCHEMBL17320239

SCHEMBL17320239

CCCCCCCOc1cccc(CCC(=O)OC)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.61
CNR2 P34972 1/20 0.61
CYP2D6 P10635 4/20 0.61
PPARG P37231 2/20 0.59
PPARA Q07869 2/20 0.59
KCNH2 Q12809 1/20 0.58
P2RY10 O00398 4/20 0.56
SMPD1 P17405 3/20 0.55
GGPS1 O95749 1/20 0.55
PLA2G4B P0C869 2/20 0.55
GPR174 Q9BXC1 3/20 0.54
GPR34 Q9UPC5 1/20 0.54

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
SCHEMBL12255204 0.95 CYP2D6 (0.59) CNR1CNR2CYP2D6PPARGPPARA
Phenyl Propionic Acid SCHEMBL28547712 0.93 PPARA (0.58) CNR1CNR2CYP2D6PPARGPPARA
SCHEMBL9120700 0.90 POLB (0.50) CNR1CNR2CYP2D6PPARGPPARA
SCHEMBL28983024 0.88 P2RY10 (0.63) CNR1CNR2CYP2D6PPARGPPARA
SCHEMBL28589342 0.88 CYP2D6 (0.61) CNR1CNR2CYP2D6PPARGPPARA
Phenyl Propionic Acid SCHEMBL28554549 0.88 FFAR1 (0.60) CYP2D6PPARGPPARAKCNH2PLA2G4B
SCHEMBL9119125 0.87 P2RY10 (0.49) CNR1CNR2CYP2D6PPARGPPARA
SCHEMBL25456542 0.86 PPARA (0.69) CNR1CNR2CYP2D6PPARGPPARA
SCHEMBL9402581 0.86 PLA2G4B (0.64) CNR1CNR2CYP2D6PPARGPPARA
SCHEMBL17345292 0.86 PPARA (0.69) CNR1CNR2CYP2D6PPARGPPARA

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-9469665-B2 Compound having lysophosphatidylserine receptor function modulation activity THE UNIVERSITY OF TOKYO (JP) 2016-10-18 US disclosed
US-20150361119-A1 COMPOUND HAVING LYSOPHOSPHATIDYLSERINE RECEPTOR FUNCTION MODULATION ACTIVITY TOHOKU UNIVERSITY (JP) 2015-12-17 US disclosed
EP-2952517-A1 COMPOUND EXHIBITING REGULATORY ACTIVITY ON LYSOPHOSPHATIDYLSERINE RECEPTOR FUNCTION The University of Tokyo (JP) 2015-12-09 EP 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-20150361119-A1 COMPOUND HAVING LYSOPHOSPHATIDYLSERINE RECEPTOR FUNCTION MODULATION ACTIVITY LPAR1, LPAR3, LPAR2 CNR1 22/4885CNR2 29/4885CYP2D6 4253/4885

“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.