SCHEMBL28146385

SCHEMBL28146385

CC=C(C)C.CCCCCCOCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.60
MEN1 O00255 1/20 0.60
THRB P10828 1/20 0.60
KMT2A Q03164 1/20 0.60
MAPT P10636 1/20 0.60
CES2 O00748 2/20 0.56
TSHR P16473 3/20 0.48
USP2 O75604 1/20 0.47
CES1 P23141 1/20 0.45
GBA1 P04062 1/20 0.45
SPHK2 Q9NRA0 1/20 0.42
SPHK1 Q9NYA1 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PLA2G2C Q5R387 1/20 0.42

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
SCHEMBL28146389 0.97 HTT (0.56) HTTMEN1THRBKMT2AMAPT
SCHEMBL27708663 0.93 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL28146384 0.90 TSHR (0.59) HTTMEN1THRBKMT2AMAPT
Methyl Alcohol SCHEMBL19714937 0.84 HTT (0.71) HTTMEN1THRBKMT2AMAPT
SCHEMBL21044684 0.84 THRB (0.70) HTTMEN1THRBKMT2AMAPT
SCHEMBL21044648 0.84 THRB (0.70) HTTMEN1THRBKMT2AMAPT
SCHEMBL21828426 0.84 THRB (0.70) HTTMEN1THRBKMT2AMAPT
SCHEMBL22268904 0.84 THRB (0.70) HTTMEN1THRBKMT2AMAPT
SCHEMBL21044639 0.84 THRB (0.70) HTTMEN1THRBKMT2AMAPT
SCHEMBL21044672 0.84 THRB (0.70) HTTMEN1THRBKMT2AMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106632507-B Metal complex and preparation method thereof, and preparation method of olefin binary copolymer 中国石油天然气股份有限公司 2019-03-12 CN disclosed
CN-106632507-A Metal complex and preparation method thereof, and preparation method of olefin binary copolymer 中国石油天然气股份有限公司 2017-05-10 CN disclosed