SCHEMBL1658548

SCHEMBL1658548

CCC/C(C)=C/CCC(C)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
KDM1A O60341 1/20 0.36
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 2/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
UGT1A1 P22309 1/20 0.34
SQLE Q14534 1/20 0.33
PTPN1 P18031 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32

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
SCHEMBL1658549 1.00 KMT2A (0.38) KMT2AKDM4EKDM1AMAPTALDH1A1
SCHEMBL1658396 0.88 KDM1A (0.41) KMT2AKDM4EKDM1ASQLEPTPN1
SCHEMBL1658397 0.88 KDM1A (0.41) KMT2AKDM4EKDM1ASQLEPTPN1
SCHEMBL2003932 0.84 KDM1A (0.44) KMT2AKDM4EKDM1AMAPTALDH1A1
SCHEMBL2003931 0.84 KDM1A (0.44) KMT2AKDM4EKDM1AMAPTALDH1A1
SCHEMBL3376001 0.84 LSS (0.40) KMT2AKDM1AMAPTMEN1CYP3A4
SCHEMBL3375999 0.84 LSS (0.40) KMT2AKDM1AMAPTMEN1CYP3A4
SCHEMBL3948580 0.83 KMT2A (0.45) KMT2AKDM4EKDM1AMAPTALDH1A1
SCHEMBL3948582 0.83 KMT2A (0.45) KMT2AKDM4EKDM1AMAPTALDH1A1
SCHEMBL1659782 0.83 KMT2A (0.38) KMT2AKDM4EKDM1AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-05-23 US disclosed
US-8377458-B2 Cooling sensation agent composition, sensory stimulation agent composition and use of the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-02-19 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
US-20110081393-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TAKASAGO INTERNATIONAL CORPORATION 2011-04-07 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 (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-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 KMT2A 3562/4885KDM4E 3549/4885KDM1A 2902/4885
US-20110081393-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 KMT2A 3700/4885KDM4E 2604/4885KDM1A 3332/4885
US-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 KMT2A 3700/4885KDM4E 2604/4885KDM1A 3332/4885

“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.