SCHEMBL118877

SCHEMBL118877

C=CC(=O)CCCC1C(C)=CCC(C)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.33
RASGRP3 Q8IV61 1/20 0.33

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
SCHEMBL2863012 0.77 TSHR (0.32) PRKCARASGRP3
SCHEMBL3375271 0.71 ALDH1A1 (0.33) PRKCARASGRP3
SCHEMBL3375272 0.71 ALDH1A1 (0.33) PRKCARASGRP3
SCHEMBL2426817 0.70 TSHR (0.37) PRKCARASGRP3
SCHEMBL2426813 0.70 TSHR (0.37) PRKCARASGRP3
SCHEMBL2426815 0.70 TSHR (0.37) PRKCARASGRP3
SCHEMBL6941490 0.69 ALDH1A1 (0.32)
SCHEMBL756421 0.69 ALOX15 (0.47)
SCHEMBL19744738 0.69 ALOX15 (0.47)
SCHEMBL18770240 0.69 ALOX15 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424355-A1 BED BUG CONTROL AND REPELLENCY Bedoukian Research, Inc. (US) 2012-03-07 EP disclosed
WO-2010126576-A1 BED BUG CONTROL AND REPELLENCY BEDOUKIAN RESEARCH, INC. 2010-11-04 WO disclosed