SCHEMBL2706115

SCHEMBL2706115

CC1=CCC(C/C=C/C(=O)O)C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.35
USP2 O75604 1/20 0.35
TDP1 Q9NUW8 3/20 0.31
GABRR1 P24046 2/20 0.31
GABRR2 P28476 2/20 0.31
BLM P54132 2/20 0.31
GABRR3 A8MPY1 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
APEX1 P27695 1/20 0.31
CYP1A2 P05177 1/20 0.30
PTGS1 P23219 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX15 P16050 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
SCHEMBL2706119 1.00 NPSR1 (0.35) NPSR1USP2TDP1GABRR1GABRR2
SCHEMBL2707257 1.00 NPSR1 (0.35) NPSR1USP2TDP1GABRR1GABRR2
SCHEMBL2426403 0.87 USP2 (0.35) NPSR1USP2TDP1ALDH1A1CYP3A4
SCHEMBL2706125 0.86 HPGD (0.37) TDP1PTGS1ALDH1A1CYP3A4ALOX15
SCHEMBL2706126 0.86 HPGD (0.37) TDP1PTGS1ALDH1A1CYP3A4ALOX15
SCHEMBL4458952 0.84 ALDH1A1 (0.43) NPSR1USP2TDP1ALDH1A1CYP3A4
SCHEMBL4458950 0.84 ALDH1A1 (0.43) NPSR1USP2TDP1ALDH1A1CYP3A4
SCHEMBL2706959 0.83
SCHEMBL2706956 0.83
SCHEMBL2707781 0.82 TTR (0.40) NPSR1USP2LMNAALDH1A1CYP3A4

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2139841-B1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2012-05-02 EP claimed
US-20100284944-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2010-11-11 US claimed
EP-2139841-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS Givaudan SA (CH) 2010-01-06 EP claimed
WO-2008119196-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-10-09 WO claimed
JP-60109537-A None JP disclosed
EP-4138574-A1 COMPOSITIONS Givaudan SA (CH) 2023-03-01 EP disclosed
WO-2021214008-A1 COMPOSITIONS GIVAUDAN SA (CH) 2021-10-28 WO disclosed
WO-2021214008-A1 COMPOSITIONS GIVAUDAN SA (CH) 2021-10-28 WO disclosed
US-20200345049-A1 COMPOSITIONS GIVAUDAN SA (CH) 2020-11-05 US disclosed
US-9451784-B2 Off-note blocking sensory organic compounds GIVAUDAN S.A. (CH) 2016-09-27 US disclosed
US-9451784-B2 Off-note blocking sensory organic compounds GIVAUDAN S.A. (CH) 2016-09-27 US disclosed
US-9451784-B2 Off-note blocking sensory organic compounds GIVAUDAN S.A. (CH) 2016-09-27 US disclosed
US-20100129833-A1 Methods to Identify Modulators GIVAUDAN SA (CH) 2010-05-27 US disclosed
EP-2139841-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS Givaudan SA (CH) 2010-01-06 EP disclosed
EP-2137322-A1 METHODS TO IDENTIFY MODULATORS Givaudan SA (CH) 2009-12-30 EP disclosed
WO-2008119195-A1 METHODS TO IDENTIFY MODULATORS GIVAUDAN SA (CH) 2008-10-09 WO disclosed
WO-2008119195-A1 METHODS TO IDENTIFY MODULATORS GIVAUDAN SA (CH) 2008-10-09 WO disclosed
WO-2008119196-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-10-09 WO disclosed
WO-2008119196-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-10-09 WO disclosed
JP-S60109537-A CYCLOPENTENE DERIVATIVE T HASEGAWA CO LTD 1985-06-15 JP 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-20100284944-A1 OFF-NOTE BLOCKING SENSORY ORGANIC COMPOUNDS SORD, OTC, ASPH NPSR1 1185/4885USP2 4815/4885TDP1 4601/4885

“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.