SCHEMBL20579161

SCHEMBL20579161

CCCCC=CCCCCCCCCCC(C)OC(=O)CCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.50
CNR1 P21554 2/20 0.50
CNR2 P34972 2/20 0.50
F7 P08709 1/20 0.49
F3 P13726 1/20 0.49
PRKCA P17252 2/20 0.48
PRKCE Q02156 1/20 0.48
PRKCQ Q04759 1/20 0.48
PRKCD Q05655 1/20 0.48
MAPT P10636 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
GMNN O75496 1/20 0.45
USP2 O75604 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALOX15 P16050 1/20 0.45
APEX1 P27695 1/20 0.45

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
SCHEMBL20579160 1.00 FAAH (0.50) FAAHCNR1CNR2F7F3
SCHEMBL17583453 1.00 FAAH (0.50) FAAHCNR1CNR2F7F3
SCHEMBL17583451 1.00 FAAH (0.50) FAAHCNR1CNR2F7F3
SCHEMBL28525133 1.00 FAAH (0.50) FAAHCNR1CNR2F7F3
SCHEMBL17583445 0.92 PRKCA (0.57) FAAHCNR1CNR2PRKCAPRKCE
SCHEMBL17583446 0.92 PRKCA (0.57) FAAHCNR1CNR2PRKCAPRKCE
SCHEMBL11648222 0.91 PRKCA (0.58) FAAHCNR1CNR2PRKCAPRKCE
SCHEMBL11648219 0.91 PRKCA (0.58) FAAHCNR1CNR2PRKCAPRKCE
SCHEMBL20969293 0.91 PRKCA (0.58) FAAHCNR1CNR2PRKCAPRKCE
SCHEMBL20969292 0.91 PRKCA (0.58) FAAHCNR1CNR2PRKCAPRKCE

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-10815504-B2 Method for producing (Z)-2-benzoyloxy-12-heptadecene and (2S,12Z)-2-hydroxy-12-heptadecene and method for producing (2S,12Z)-2-acetoxy-12-heptadecene SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-10-27 US disclosed
US-20180355386-A1 METHOD FOR PRODUCING (Z)-2-BENZOYLOXY-12-HEPTADECENE AND (2S,12Z)-2-HYDROXY-12-HEPTADECENE AND METHOD FOR PRODUCING (2S,12Z)-2-ACETOXY-12-HEPTADECENE SHINETSU CHEMICAL CO (JP) 2018-12-13 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 (2 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-10815504-B2 Method for producing (Z)-2-benzoyloxy-12-heptadecene and (2S,12Z)-2-hydroxy-12-heptadecene and method for producing (2S,12Z)-2-acetoxy-12-heptadecene CYP51A1, LIPE, CYP8B1 FAAH 54/4885CNR1 575/4885CNR2 451/4885
US-20180355386-A1 METHOD FOR PRODUCING (Z)-2-BENZOYLOXY-12-HEPTADECENE AND (2S,12Z)-2-HYDROXY-12-HEPTADECENE AND METHOD FOR PRODUCING (2S,12Z)-2-ACETOXY-12-HEPTADECENE CYP51A1, LIPE, CYP8B1 FAAH 54/4885CNR1 575/4885CNR2 451/4885

“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.