SCHEMBL13627809

SCHEMBL13627809

C#CCCCCOCCOCCC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SPHK2 Q9NRA0 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
SCHEMBL6015395 0.98 MAPT (0.37) MAPTHTTMEN1THRBKMT2A
SCHEMBL23015153 0.95 MAPT (0.40) MAPTHTTMEN1THRBKMT2A
SCHEMBL14480297 0.95 MAPT (0.40) MAPTHTTMEN1THRBKMT2A
SCHEMBL15775433 0.91
SCHEMBL23567273 0.89 USP2 (0.31) MAPTHTTMEN1THRBKMT2A
SCHEMBL19233495 0.88 MAPT (0.37) MAPTHTTMEN1THRBKMT2A
SCHEMBL23567314 0.87 MAPT (0.33) MAPTHTTMEN1THRBKMT2A
SCHEMBL23567248 0.87 MAPT (0.33) MAPTHTTMEN1THRBKMT2A
SCHEMBL23567235 0.87 MAPT (0.33) MAPTHTTMEN1THRBKMT2A
SCHEMBL23567321 0.87 MAPT (0.33) MAPTHTTMEN1THRBKMT2A

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-7612153-B2 conjugate polymer drugs; endcapped polyethers; nontoxic, biocompatible, non-immunogenic, soluble in water and other solvents INTEZYNE TECHNOLOGIES, INC. (US) 2009-11-03 US disclosed