SCHEMBL20536818

SCHEMBL20536818

CCCCCCCCCCC=CC=COCOC

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
FASN P49327 1/20 0.46
FAAH O00519 8/20 0.41
TRPV1 Q8NER1 1/20 0.41
KDM4E B2RXH2 1/20 0.39
CNR1 P21554 3/20 0.37
CNR2 P34972 3/20 0.37

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
SCHEMBL29801150 1.00 ALDH1A1 (0.47) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL27126037 0.98 ALDH1A1 (0.50) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL27124679 0.96 ALDH1A1 (0.48) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL28635750 0.88 FAAH (0.43) FAAHTRPV1
SCHEMBL31106218 0.88 FAAH (0.43) FAAHTRPV1
SCHEMBL28728089 0.88 FAAH (0.43) FAAHTRPV1
SCHEMBL31106158 0.88 FAAH (0.43) FAAHTRPV1
SCHEMBL17377412 0.80 ALDH1A1 (0.50) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL13038618 0.79 ALDH1A1 (0.46) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL8674217 0.78 ALDH1A1 (0.53) ALDH1A1TSHRFASNFAAHTRPV1

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-20240140902-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS MELCHIOR MATERIAL AND LIFE SCIENCE FRANCE (FR) 2024-05-02 US disclosed
EP-4291169-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS Melchior Material And Life Science France (FR) 2023-12-20 EP disclosed
WO-2022171965-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS MELCHIOR MATERIAL AND LIFE SCIENCE FRANCE (FR) 2022-08-18 WO disclosed
EP-3392230-B1 METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND SHINETSU CHEMICAL CO (JP) 2020-03-04 EP disclosed
US-10138179-B2 Method for producing 2,4-dienal acetal compound and 2,4-dienal compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-11-27 US disclosed
US-20180305276-A1 METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-10-25 US disclosed
EP-3392230-A1 METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND Shin-Etsu Chemical Co., Ltd. (JP) 2018-10-24 EP 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 (3 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-10138179-B2 Method for producing 2,4-dienal acetal compound and 2,4-dienal compound SRD5A2, OR51E2, AR ALDH1A1 407/4885TSHR 1713/4885FASN 1640/4885
US-20180305276-A1 METHOD FOR PRODUCING 2,4-DIENAL ACETAL COMPOUND AND 2,4-DIENAL COMPOUND SRD5A2, OR51E2, AR ALDH1A1 407/4885TSHR 1713/4885FASN 1640/4885
US-20240140902-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS GALR1, PTAR1, GALR3 ALDH1A1 649/4885TSHR 368/4885FASN 4005/4885

“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.