SCHEMBL20145238

SCHEMBL20145238

CCCCCCOC(C)(NCCCCCN)OCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.45
EPHX1 P07099 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
SLC6A5 Q9Y345 2/20 0.35
RELA Q04206 3/20 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
SCHEMBL20145294 0.91 EPHX1 (0.39) EPHX1ALDH1A1TSHR
SCHEMBL28353998 0.77 EPHX1 (0.41) EPHX1ALDH1A1TSHR
SCHEMBL15256845 0.77 DNM1 (0.56) DNM1EPHX1MEN1KMT2AALDH1A1
SCHEMBL10580311 0.77 EPHX1 (0.41) EPHX1ALDH1A1TSHR
SCHEMBL20145227 0.77 DNM1 (0.56) DNM1EPHX1MEN1KMT2AALDH1A1
SCHEMBL15256852 0.77 DNM1 (0.56) DNM1EPHX1MEN1KMT2AALDH1A1
SCHEMBL15256779 0.75 DNM1 (0.59) DNM1EPHX1MEN1KMT2AALDH1A1
SCHEMBL15256772 0.75 DNM1 (0.52) DNM1EPHX1MEN1KMT2AALDH1A1
SCHEMBL24027311 0.73 DNM1 (0.50) DNM1EPHX1MEN1KMT2AALDH1A1
SCHEMBL19558842 0.73 DNM1 (0.50) DNM1EPHX1MEN1KMT2AALDH1A1

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-2646410-B1 NOVEL AGENTS FOR REWORKABLE EPOXY RESINS CONNORA TECH INC (US) 2018-05-16 EP disclosed