SCHEMBL1658807

SCHEMBL1658807

CCC(C)(C)CCCCCO

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 1/20 0.46
CYP4F2 P78329 2/20 0.45
CYP4A11 Q02928 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FFAR1 O14842 1/20 0.41
CPT2 P23786 1/20 0.41
KDM4E B2RXH2 1/20 0.33
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL1660492 1.00 LMNA (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL27541923 1.00 LMNA (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1658078 0.97 SMN1; SMN2 (0.43) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL497383 0.95
SCHEMBL21846630 0.87 CYP4F2 (0.38) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL15297874 0.86 TDP1 (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL20437994 0.86 TDP1 (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL20438000 0.86 TDP1 (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL20438002 0.86 TDP1 (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1836223 0.86 TDP1 (0.43) TSHRTDP1FFAR1CPT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014171894-A1 SYNTHESIS OF CYCLIC CARBONATES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-10-23 WO disclosed
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
CN-102481250-A Sublingual and oral film compositions MONOSOL RX LLC 2012-05-30 CN 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 LMNA 1708/4885ALDH1A1 520/4885HSD17B10 2048/4885
US-20110081393-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 LMNA 1727/4885ALDH1A1 685/4885HSD17B10 880/4885
US-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 LMNA 1727/4885ALDH1A1 685/4885HSD17B10 880/4885

“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.