SCHEMBL4659028

SCHEMBL4659028

CCNCC(NCC)(NCC)NCC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
CYP2C19 P33261 2/20 0.32
MEN1 O00255 1/20 0.32
GLA P06280 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 1/20 0.30
TSHR P16473 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
SCHEMBL234928 0.84 TP53 (0.33) TP53
SCHEMBL1253582 0.76
SCHEMBL234929 0.73
SCHEMBL7064655 0.73 TP53 (0.39) TP53CYP2C19MEN1GLAKMT2A
SCHEMBL9645109 0.71 TP53 (0.37) TP53
SCHEMBL20836712 0.71 TP53 (0.37) TP53
SCHEMBL1765897 0.71 TP53 (0.37) TP53
SCHEMBL236326 0.71 TP53 (0.37) TP53
SCHEMBL19934646 0.69 TP53 (0.35) TP53
Ammonia Solution, Strong SCHEMBL7176729 0.69 TP53 (0.35) TP53

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-1664167-B1 THE POLYELECTROLYTE COMPOSITION FOR HUMIDITY SENSOR, POLYELECTROLYTE INK AND PREPARATION METHOD OF POLYELECTROLYTE MEMBRANE FOR SENSOR BY INKJET PRINTING HAEUN CHEMTEC CO LTD (KR) 2008-12-10 EP claimed