SCHEMBL6743990

SCHEMBL6743990

CCN(CC)CCCCC(N)(CCCN)CCCCN(CC)CC

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.40
ARG1 P05089 2/20 0.36
ARG2 P78540 2/20 0.36
CHRM2 P08172 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL6746408 0.96 SIGMAR1 (0.40) SIGMAR1ARG1ARG2CHRM2NPSR1
SCHEMBL6745359 0.94 CHRM2 (0.41) SIGMAR1ARG1ARG2CHRM2
SCHEMBL6743713 0.84 CHRM2 (0.35) CHRM2
SCHEMBL177755 0.79 CHRM2 (0.50) SIGMAR1CHRM2
SCHEMBL5011436 0.77 CHRM2 (0.55) SIGMAR1CHRM2
SCHEMBL5891997 0.77 CHRM2 (0.55) SIGMAR1CHRM2
SCHEMBL5892033 0.77 CHRM2 (0.55) SIGMAR1CHRM2
Hydrochloric Acid SCHEMBL29648462 0.77 CHRM2 (0.48) SIGMAR1CHRM2
SCHEMBL8391473 0.77 CHRM2 (0.55) SIGMAR1CHRM2
SCHEMBL578556 0.77 CHRM2 (0.55) SIGMAR1CHRM2

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