SCHEMBL17079529

SCHEMBL17079529

C=CCC(C)CCOC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.56
ALDH1A1 P00352 5/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
USP2 O75604 2/20 0.37
CYP3A4 P08684 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
TSHR P16473 2/20 0.36
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
HTR1A P08908 1/20 0.36
CHRNB2 P17787 1/20 0.36
TBXA2R P21731 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36

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
SCHEMBL1614306 0.82 ALOX15 (0.58) ALOX15ALDH1A1SMN1; SMN2CHRM5CHRM1
SCHEMBL17079536 0.81 NAAA (0.40) ALOX15ALDH1A1TDP1HPGDTSHR
SCHEMBL7552905 0.81 ALOX15 (0.70) ALOX15ALDH1A1SMN1; SMN2CHRM5CHRM1
SCHEMBL12266939 0.79 ALOX15 (0.59) ALOX15ALDH1A1SMN1; SMN2CYP3A4HPGD
SCHEMBL6135683 0.79 ALOX15 (0.50) ALOX15ALDH1A1TDP1SMN1; SMN2USP2
SCHEMBL6135686 0.79 ALOX15 (0.50) ALOX15ALDH1A1TDP1SMN1; SMN2USP2
SCHEMBL31538353 0.78 ALOX15 (0.53) ALOX15ALDH1A1TDP1SMN1; SMN2CYP3A4
SCHEMBL9506913 0.78 ALOX15 (0.56) ALOX15ALDH1A1SMN1; SMN2CHRM5CHRM1
SCHEMBL18663490 0.77 ALOX15 (0.51) ALOX15ALDH1A1TDP1SMN1; SMN2USP2
SCHEMBL10592155 0.75 ALOX15 (0.58) ALOX15ALDH1A1SMN1; SMN2CHRM5CHRM1

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
EP-3116848-B1 PROCESS INVOLVING CROSS METATHESIS OF OLEFINS GIVAUDAN SA (CH) 2023-12-27 EP disclosed
CN-106103403-B Process comprising cross metathesis of olefins 奇华顿股份有限公司 2020-05-19 CN disclosed
US-20190100504-A1 Process Involving Cross Metathesis of Olefins GIVAUDAN S.A. (CH) 2019-04-04 US disclosed
US-10144720-B2 Process involving cross metathesis of olefins GIVAUDAN S.A. (CH) 2018-12-04 US disclosed
EP-3116848-A1 PROCESS INVOLVING CROSS METATHESIS OF OLEFINS Givaudan S.A. (CH) 2017-01-18 EP disclosed
US-20160368888-A1 Process Involving Cross Metathesis of Olefins GIVAUDAN S.A. (CH) 2016-12-22 US disclosed
WO-2015136093-A1 PROCESS INVOLVING CROSS METATHESIS OF OLEFINS GIVAUDAN SA (CH) 2015-09-17 WO 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-10144720-B2 Process involving cross metathesis of olefins SYMPK, CLK1, MOK ALOX15 1204/4885ALDH1A1 4255/4885TDP1 4095/4885
US-20190100504-A1 Process Involving Cross Metathesis of Olefins SYMPK, CLK1, MOK ALOX15 1204/4885ALDH1A1 4255/4885TDP1 4095/4885
US-20160368888-A1 Process Involving Cross Metathesis of Olefins SYMPK, CLK1, MOK ALOX15 1204/4885ALDH1A1 4255/4885TDP1 4095/4885

“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.