SCHEMBL28080747

SCHEMBL28080747

C=C(C(=O)OC)C(C)(C)C.C=C(Cc1ccccc1)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 3/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CES1 P23141 2/20 0.39
CES2 O00748 1/20 0.39
AKR1B1 P15121 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
NPC1 O15118 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
POLB P06746 2/20 0.38

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
SCHEMBL1666500 0.89 CES2 (0.48) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28118587 0.89 CES2 (0.48) ALDH1A1KDM4ELMNARAB9AMAPT
Hydrochloric Acid SCHEMBL28053659 0.85 CES2 (0.45) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28327231 0.83 ALDH1A1 (0.43) ALDH1A1KDM4ELMNARAB9AMAPT
Methacrylic Acid SCHEMBL27594680 0.83 ALDH1A1 (0.43) ALDH1A1KDM4ELMNARAB9AMAPT
Acrylic Acid SCHEMBL28163684 0.81 ALDH1A1 (0.42) ALDH1A1KDM4ELMNARAB9AMAPT
Propanol SCHEMBL28071399 0.81 POLB (0.45) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28227538 0.80 RAB9A (0.42) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28076128 0.80 ALDH1A1 (0.41) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28835498 0.80 LMNA (0.55) ALDH1A1LMNARAB9AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105555818-B The manufacture method of block copolymer and the block copolymer obtained using this method DIC株式会社 2018-04-24 CN disclosed
CN-104395358-B Comb copolymer containing ion-type binding groups 比克化学股份有限公司 2016-12-07 CN disclosed
CN-105793319-A Polyamine addition compounds 比克化学股份有限公司 2016-07-20 CN disclosed