SCHEMBL14699696

SCHEMBL14699696

C=C(C)C(=O)OC(CCC)CCCC1CCC(OC(=O)C(=C)C)CC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
NAAA Q02083 1/20 0.36
TSHR P16473 2/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL2783780 0.82 NAAA (0.48) MAPTNAAATSHRTP53
SCHEMBL23572220 0.81 NAAA (0.44) MAPTNAAATSHRTP53
SCHEMBL15667591 0.80 TSHR (0.46) MAPTNAAATSHRTP53
SCHEMBL12177972 0.79 NAAA (0.45) MAPTNAAATSHRTP53
SCHEMBL92857 0.78 NR5A2 (0.34) NAAATSHR
SCHEMBL1692337 0.76 TSHR (0.46) MAPTTSHR
SCHEMBL11863394 0.76 ALDH1A1 (0.46) TSHR
SCHEMBL28381621 0.75 ATM (0.30)
SCHEMBL18456081 0.75 TSHR (0.49) MAPTTSHR
SCHEMBL21670808 0.73 TSHR (0.51) MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2557140-A2 Liquid-crystalline medium Merck Patent GmbH (DE) 2013-02-13 EP disclosed