SCHEMBL6338178

SCHEMBL6338178

CCCCCCCC/C=C\CCCCCCCC(=O)NCC(COP(=O)(O)O)OC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 6/20 0.54
LPAR3 Q9UBY5 6/20 0.54
ENPP2 Q13822 2/20 0.53
LPAR2 Q9HBW0 1/20 0.53
S1PR1 P21453 1/20 0.53
FAAH O00519 2/20 0.52
EPHX2 P34913 2/20 0.52
PLA2G4A P47712 1/20 0.52
P2RY10 O00398 1/20 0.51
GPR174 Q9BXC1 1/20 0.51
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50

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
SCHEMBL6338180 1.00 LPAR1 (0.54) LPAR1LPAR3ENPP2LPAR2S1PR1
SCHEMBL6348306 0.84 EPHX2 (0.51) LPAR1FAAHEPHX2CNR1CNR2
SCHEMBL6348309 0.84 EPHX2 (0.51) LPAR1FAAHEPHX2CNR1CNR2
SCHEMBL8508082 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A
SCHEMBL6348463 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A
SCHEMBL6336785 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A
SCHEMBL6338286 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A
SCHEMBL6337771 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A
SCHEMBL6338834 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A
SCHEMBL6345807 0.78 P2RY10 (0.73) LPAR1LPAR3ENPP2LPAR2PLA2G4A

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-6911553-B1 Osteoblast-specific mitogens and drugs containing such compounds ROCHE DIAGNOSTICS GMBH (DE) 2005-06-28 US disclosed
US-20050014723-A1 Osteoblast-specific mitogens and drugs containing such compounds ESSWEIN ANGELIKA (DE) 2005-01-20 US disclosed
US-6197759-B1 ADMINISTERING LYSOPHOSPHATIDYLIC ACID DERIVATIVE ROCHE DIAGNOSTICS GMBH (DE) 2001-03-06 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-20050014723-A1 Osteoblast-specific mitogens and drugs containing such compounds LPAR1, LPAR2, LPAR4 LPAR1 1/4885LPAR3 7/4885ENPP2 9/4885

“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.