SCHEMBL1781778

SCHEMBL1781778

CCCCC(C)CCCC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.48
MAPT P10636 1/20 0.43
CA2 P00918 5/20 0.40
MAPK1 P28482 1/20 0.40
CES1 P23141 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CA1 P00915 2/20 0.39
PTPN1 P18031 2/20 0.39
CES2 O00748 1/20 0.39
NFKB1 P19838 1/20 0.38
ACHE P22303 1/20 0.38
PAOX Q6QHF9 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL29037991 0.96 ACE2 (0.55) ACE2MAPTCA2CA1PTPN1
SCHEMBL29074818 0.93 ACE2 (0.52) ACE2MAPTCA2MAPK1CES1
SCHEMBL6818448 0.93 ACE2 (0.57) ACE2MAPTCES1CA1PTPN1
SCHEMBL16431305 0.91 ACE2 (0.60) ACE2MAPTCES1CA1PTPN1
SCHEMBL14642133 0.91 ACE2 (0.60) ACE2MAPTCES1CA1PTPN1
SCHEMBL29037990 0.91 ACE2 (0.60) ACE2MAPTCES1CA1PTPN1
SCHEMBL18522805 0.91 ACE2 (0.55) ACE2CA2MAPK1CES1ALDH1A1
SCHEMBL29222506 0.91 ACE2 (0.55) ACE2CA2MAPK1CES1ALDH1A1
SCHEMBL1783660 0.91 ACE2 (0.44) ACE2MAPTCES1ALDH1A1CA1
SCHEMBL14681977 0.91 ACE2 (0.44) ACE2MAPTCES1ALDH1A1CA1

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-20250000088-A1 ANT CONTROL AGENT AND ANT CONTROL METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2025-01-02 US disclosed
EP-4424164-A1 ANT CONTROL AGENT AND ANT CONTROL METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-09-04 EP disclosed
CN-118139527-A Ant control agent and ant control method 信越化学工业株式会社 2024-06-04 CN disclosed
WO-2023074396-A1 ANT CONTROL AGENT AND ANT CONTROL METHOD 信越化学工業株式会社 2023-05-04 WO disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 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 (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 ACE2 4401/4885MAPT 906/4885CA2 3566/4885

“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.