SCHEMBL17583446

SCHEMBL17583446

CCCCC=CCCCCCCCCC[C@@H](C)OC(=O)CCCCC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.57
PRKCE Q02156 1/20 0.57
PRKCQ Q04759 1/20 0.57
PRKCD Q05655 1/20 0.57
LMNA P02545 3/20 0.56
FAAH O00519 5/20 0.54
CNR1 P21554 2/20 0.54
CNR2 P34972 2/20 0.54
MAPT P10636 2/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
DGKA P23743 1/20 0.52
SLC6A5 Q9Y345 1/20 0.52
GMNN O75496 1/20 0.51
USP2 O75604 1/20 0.51
CYP1A2 P05177 1/20 0.51
POLB P06746 1/20 0.51
CYP2C9 P11712 1/20 0.51
ALOX15 P16050 1/20 0.51
APEX1 P27695 1/20 0.51

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
SCHEMBL17583445 1.00 PRKCA (0.57) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL5028803 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL20969292 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL20969293 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL11648219 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL11648222 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL29269590 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL29002746 0.98 PRKCA (0.58) PRKCAPRKCEPRKCQPRKCDLMNA
SCHEMBL20969311 0.93 PPARG (0.64) LMNAFAAHMAPTALDH1A1HPGD
SCHEMBL20579161 0.92 FAAH (0.50) PRKCAPRKCEPRKCQPRKCDLMNA

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 7 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
CN-105420285-B Preparation method of heptadecene compound 信越化学工业株式会社 2020-10-16 CN 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
US-10081820-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) 2018-09-25 US disclosed
EP-2998286-B1 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) 2017-05-31 EP disclosed
EP-2998286-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 Shin-Etsu Chemical Co., Ltd. (JP) 2016-03-23 EP disclosed
US-20160076063-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 SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-03-17 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 (4 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 PRKCA 2833/4885PRKCE 1631/4885PRKCQ 3120/4885
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 PRKCA 2833/4885PRKCE 1631/4885PRKCQ 3120/4885
US-20160076063-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 PRKCA 2833/4885PRKCE 1631/4885PRKCQ 3120/4885
US-10081820-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 PRKCA 2833/4885PRKCE 1631/4885PRKCQ 3120/4885

“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.