SCHEMBL6745359

SCHEMBL6745359

CCN(CC)CCCCC(N)(CCCCCN)CCCCN(CC)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.41
SIGMAR1 Q99720 1/20 0.39
DNM1 Q05193 9/20 0.36
TSHR P16473 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
EPHX1 P07099 1/20 0.36
ARG1 P05089 2/20 0.35
ARG2 P78540 2/20 0.35
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 2/20 0.32

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
SCHEMBL6746408 0.98 SIGMAR1 (0.40) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL6743990 0.94 SIGMAR1 (0.40) CHRM2SIGMAR1ARG1ARG2
SCHEMBL8391473 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL5011436 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL5891994 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL5891997 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL5892033 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL578556 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL757465 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1
SCHEMBL8390578 0.85 CHRM2 (0.55) CHRM2SIGMAR1DNM1TSHRMEN1

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
US-6689919-B1 SOLUBLE POLY(OXYFLUOROPHENYLENE) COMPOUNDS WITH EXCELLENT HEAT RESISTANCE, MEMBRANE-FORMABILITY AND CHEMICAL STABILITY JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2004-02-10 US disclosed