SCHEMBL19458798

SCHEMBL19458798

CCOC(CCCCCCCCC/C=C\CCCl)OCC

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.33
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
TRPV1 Q8NER1 1/20 0.31
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL29621061 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621420 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621101 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621310 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621397 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL19458671 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621414 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621017 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL19458703 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1
SCHEMBL29621281 1.00 FAAH (0.33) FAAHCNR1CNR2TRPV1FFAR1

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
CN-114380673-B Dialkoxy alkenyl alkoxy methyl ether compound and method for preparing terminal conjugated alkadiene aldehyde compound from same 信越化学工业株式会社 2024-09-13 CN disclosed
CN-114380673-A Dialkoxyalkenylalkoxymethyl ether compounds and process for producing conjugated alkadienal compounds from the same 信越化学工业株式会社 2022-04-22 CN disclosed
CN-107304163-B Method for producing aliphatic aldehyde compound having terminal conjugated diene structure and intermediate for use in said method 信越化学工业株式会社 2020-12-25 CN disclosed
EP-3235798-B1 METHOD OF PRODUCING ALIPHATIC ALDEHYDE COMPOUND HAVING TERMINAL CONJUGATED DIENE STRUCTURE AND INTERMEDIATE THEREFOR SHINETSU CHEMICAL CO (JP) 2018-11-07 EP disclosed
US-10040742-B2 Method of producing aliphatic aldehyde compound having terminal conjugated diene structure and intermediate therefor SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-08-07 US disclosed
EP-3235798-A1 METHOD OF PRODUCING ALIPHATIC ALDEHYDE COMPOUND HAVING TERMINAL CONJUGATED DIENE STRUCTURE AND INTERMEDIATE THEREFOR Shin-Etsu Chemical Co., Ltd. (JP) 2017-10-25 EP disclosed
US-20170297987-A1 METHOD OF PRODUCING ALIPHATIC ALDEHYDE COMPOUND HAVING TERMINAL CONJUGATED DIENE STRUCTURE AND INTERMEDIATE THEREFOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-10-19 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-20170297987-A1 METHOD OF PRODUCING ALIPHATIC ALDEHYDE COMPOUND HAVING TERMINAL CONJUGATED DIENE STRUCTURE AND INTERMEDIATE THEREFOR ALDH7A1, ALDH16A1, FAR1 FAAH 351/4885CNR1 2997/4885CNR2 2753/4885
US-10040742-B2 Method of producing aliphatic aldehyde compound having terminal conjugated diene structure and intermediate therefor ALDH7A1, ALDH16A1, FAR1 FAAH 351/4885CNR1 2997/4885CNR2 2753/4885

“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.