SCHEMBL4472870

SCHEMBL4472870

CCCCCCCCC=CCCCCCCCC(=O)C(C)(CC(O)(NC)C(C)(C(=O)O)C(=O)CCCCCCCC=CCCCCCCCC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 4/20 0.47
▸ CES1 P23141 2/20 0.47
▸ PPARG P37231 5/20 0.44
▸ PPARD Q03181 5/20 0.44
▸ PPARA Q07869 5/20 0.44
▸ F7 P08709 4/20 0.44
▸ F3 P13726 4/20 0.44
▸ TERT O14746 3/20 0.44
▸ PTPN1 P18031 3/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ FABP4 P15090 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ BLM P54132 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ALOX15 P16050 2/20 0.44
▸ DUSP3 P51452 2/20 0.44
▸ CYP19A1 P11511 2/20 0.44
▸ PTGS1 P23219 2/20 0.44
▸ NR4A2 P43354 2/20 0.44
▸ SIRT6 Q8N6T7 2/20 0.44

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
SCHEMBL22371943 0.92 FAAH (0.40) FAAHCES1PPARGPPARDPPARA
SCHEMBL4464062 0.82 FAAH (0.48) FAAHCES1PPARGPPARDPPARA
SCHEMBL18065604 0.75 FAAH (0.41) FAAHCES1PPARGPPARDPPARA
SCHEMBL2255086 0.73 FAAH (0.63) FAAHCES1PPARGPPARDPPARA
SCHEMBL2255088 0.73 FAAH (0.63) FAAHCES1PPARGPPARDPPARA
SCHEMBL25415552 0.73 FAAH (0.67) FAAHCES1PPARGPPARDPPARA
SCHEMBL27730742 0.72 FAAH (0.61) FAAHCES1PPARGPPARDPPARA
SCHEMBL8108035 0.72 FAAH (0.61) FAAHCES1PPARGPPARDPPARA
SCHEMBL27529283 0.72 FAAH (0.61) FAAHCES1PPARGPPARDPPARA
SCHEMBL3489437 0.72 FAAH (0.65) FAAHCES1PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7597881-B2 Use of ester quats in compositions as sand-repellent substances GOLDSCHMIDT GMBH (DE) 2009-10-06 — — US claimed
US-20070231289-A1 Use of ester quats in compositions as sand-repellent substances GOLDSCHMIDT GMBH (DE) 2007-10-04 — — US claimed

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-20070231289-A1 Use of ester quats in compositions as sand-repellent substances CUTA, DLAT, CRAT FAAH 105/4885CES1 120/4885PPARG 171/4885

“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.

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