SCHEMBL1759155

SCHEMBL1759155

CC/C=C\CC(=O)OCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.50
NAAA Q02083 1/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 2/20 0.47
HPGD P15428 1/20 0.47
HCAR2 Q8TDS4 2/20 0.44
DGKA P23743 1/20 0.44
HTR2C P28335 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
RAD52 P43351 1/20 0.42
FAAH O00519 2/20 0.41
NR1I2 O75469 1/20 0.40
PGR P06401 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
PTGS2 P35354 1/20 0.40
PDE4D Q08499 1/20 0.40
MGLL Q99685 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 2/20 0.39

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
SCHEMBL1759154 1.00 ATM (0.50) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL1759156 1.00 ATM (0.50) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL28488567 0.94 ATM (0.56) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL10876249 0.94 ATM (0.56) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL12157464 0.92 NAAA (0.60) ATMNAAATSHRHCAR2DGKA
SCHEMBL27564152 0.88 HCAR2 (0.41) ATMNAAAALDH1A1TSHRHCAR2
SCHEMBL12803597 0.86 FAAH (0.51) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL12803685 0.86 ATM (0.48) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL12803688 0.86 ATM (0.48) ATMNAAAALDH1A1TSHRHPGD
SCHEMBL12803598 0.86 FAAH (0.51) ATMNAAAALDH1A1TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121181426-A Preparation method and application of cis-3-hexenoic acid butyl ester 广州市名花香料有限公司 2025-12-23 CN disclosed
CN-121181426-A Preparation method and application of cis-3-hexenoic acid butyl ester 广州市名花香料有限公司 2025-12-23 CN disclosed
US-8871967-B2 Esters as perfuming ingredients FIRMENICH SA (CH) 2014-10-28 US disclosed
EP-2496548-B1 Esters as perfuming ingredients FIRMENICH & CIE (CH) 2013-08-28 EP disclosed
EP-2496548-A1 ESTERS AS PERFUMING INGREDIENTS Firmenich S.A. (CH) 2012-09-12 EP disclosed
US-20120195844-A1 ESTERS AS PERFUMING INGREDIENTS FIRMENICH SA (CH) 2012-08-02 US disclosed
WO-2011055251-A1 ESTERS AS PERFUMING INGREDIENTS FIRMENICH SA (CH) 2011-05-12 WO disclosed
CN-101309665-B Sorbitol esters as perfuming ingredients FIRMENICH & CIE 2011-01-12 CN disclosed
CN-101309665-A Sorbitol esters as perfuming ingredients FIRMENICH & CIE (CH) 2008-11-19 CN 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 (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-20120195844-A1 ESTERS AS PERFUMING INGREDIENTS C5, CBR3, C1S ATM 2613/4885NAAA 1206/4885ALDH1A1 929/4885

“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.