SCHEMBL4843434

SCHEMBL4843434

CC(C)C1CCCCCCC1O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.50
TRPM8 Q7Z2W7 2/20 0.50
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
SLC6A4 P31645 1/20 0.33
OPRM1 P35372 1/20 0.33
KDR P35968 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TSHR P16473 1/20 0.33
SLC18A3 Q16572 3/20 0.32
EPHX1 P07099 2/20 0.32
GSR P00390 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
SCHEMBL3914000 1.00 TRPA1 (0.50) TRPA1TRPM8CA1CA2CA4
SCHEMBL280337 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL16202652 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL13312942 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL7752845 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL19818246 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL680648 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL3047337 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL22601293 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4
SCHEMBL10070056 0.97 TRPA1 (0.52) TRPA1TRPM8CA1CA2CA4

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
EP-1710223-B1 PROCESS FOR PRODUCING ALDEHYDE COMPOUND OR KETONE COMPOUND WITH USE OF MICROREACTOR UBE INDUSTRIES (JP) 2012-10-31 EP disclosed
US-7332632-B2 Method for producing aldehyde compound or ketone compound by using microreactor Ubē Industries, Ltd. (JP) 2008-02-19 US disclosed
US-20070149823-A1 Method for producing aldehyde compound or ketone compound by using microreactor UBE INDUSTRIES, LTD., A CORPORATION OF JAPAN (JP) 2007-06-28 US disclosed
EP-1710223-A1 PROCESS FOR PRODUCING ALDEHYDE COMPOUND OR KETONE COMPOUND WITH USE OF MICROREACTOR Ube Industries, Ltd. (JP) 2006-10-11 EP disclosed
EP-0902786-B1 SYNTHESIS OF CYCLOALKYLDIARYLPHOSPHINES ALBEMARLE CORP (US) 2005-06-22 EP disclosed
EP-0902786-A1 SYNTHESIS OF CYCLOALKYLDIARYLPHOSPHINES ALBEMARLE CORPORATION (US) 1999-03-24 EP disclosed
US-5710340-A Synthesis of cycloalkyldiarylphosophines ALBEMARLE CORPORATION (US) 1998-01-20 US disclosed
WO-1997041131-A1 SYNTHESIS OF CYCLOALKYLDIARYLPHOSPHINES ALBEMARLE CORPORATION (US) 1997-11-06 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-20070149823-A1 Method for producing aldehyde compound or ketone compound by using microreactor ADH1C, ADH1A, ALDH1A1 TRPA1 836/4885TRPM8 1287/4885CA1 1026/4885

“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.