SCHEMBL1682252

SCHEMBL1682252

CCCCCCCCCCCCCCCCCC(=O)OC1CC(C)CCC1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.53
EPHX1 P07099 2/20 0.49
NAAA Q02083 2/20 0.49
ALDH1A1 P00352 7/20 0.47
TSHR P16473 2/20 0.47
MAPT P10636 2/20 0.47
USP2 O75604 1/20 0.47
LMNA P02545 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
PRKCA P17252 3/20 0.43

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
SCHEMBL27339394 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL27818008 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL28305070 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL29053351 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL20496946 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL6748094 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL2029587 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL9151592 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL1682255 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR
SCHEMBL27925156 1.00 CYP19A1 (0.53) CYP19A1EPHX1NAAAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114369340-A Material containing ultraviolet absorbent and preparation method thereof 中国农业科学院农业环境与可持续发展研究所 2022-04-19 CN claimed
CN-104684412-B Powdery refreshing agent composition 小川香料株式会社 2017-09-01 CN disclosed
CN-104684412-A Powdery refreshing agent composition OGAWA & CO LTD 2015-06-03 CN disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
CN-101157612-B Organic acid menthol derivative and transdermal drug delivery preparation having the same UNIV SHENYANG PHARMACEUTICAL 2013-05-29 CN disclosed
EP-2488463-A1 LATENT HEAT STORAGE MATERIALS Berry, Michael Trevor (GB) 2012-08-22 EP disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2011045574-A1 LATENT HEAT STORAGE MATERIALS BERRY MICHAEL TREVOR (GB) 2011-04-21 WO disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed
CN-101157612-A Organic acid menthol derivative and transdermal drug delivery preparation having the same UNIV SHENYANG PHARMACEUTICAL (CN) 2008-04-09 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-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 CYP19A1 1497/4885EPHX1 390/4885NAAA 3112/4885

“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.