SCHEMBL4918289

SCHEMBL4918289

CCCCCCCC/C=C\CCCCCCCCO[PH](=O)O.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.53
LPAR1 Q92633 2/20 0.53
LPAR2 Q9HBW0 2/20 0.53
FAAH O00519 4/20 0.47
TRPV1 Q8NER1 1/20 0.47
TERT O14746 3/20 0.46
CYP1A2 P05177 2/20 0.46
MAPT P10636 2/20 0.46
CYP2C19 P33261 2/20 0.46
BLM P54132 2/20 0.46
HSD17B10 Q99714 2/20 0.46
FABP4 P15090 2/20 0.46
PTPN1 P18031 2/20 0.46
PPARG P37231 2/20 0.46
KMT2A Q03164 2/20 0.46
PPARD Q03181 2/20 0.46
PPARA Q07869 2/20 0.46
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL7120722 1.00 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL3719973 0.98 LPAR3 (0.54) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL3712984 0.98 LPAR3 (0.54) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL672379 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL7127580 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL674424 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
Phosphonic Acid SCHEMBL28417856 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL3962398 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
SCHEMBL639814 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1
Butane SCHEMBL3793662 0.96 LPAR3 (0.53) LPAR3LPAR1LPAR2FAAHTRPV1

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-20080063714-A1 Compositions for Encapsulation and Controlled Release 3M INNOVATIVE PROPERTIES COMPANY 2008-03-13 US disclosed
EP-1651035-A2 COMPOSITIONS FOR ENCAPSULATION AND CONTROLLED RELEASE 3M Innovative Properties Company (US) 2006-05-03 EP disclosed
WO-2005012488-A2 COMPOSITIONS FOR ENCAPSULATION AND CONTROLLED RELEASE 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-02-10 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-20080063714-A1 Compositions for Encapsulation and Controlled Release CHMP4B, DDC, ANXA5 LPAR3 3862/4885LPAR1 4213/4885LPAR2 4380/4885

“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.