SCHEMBL28076128

SCHEMBL28076128

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 3/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
AKR1B1 P15121 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
NPC1 O15118 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TSHR P16473 1/20 0.39
GAA P10253 1/20 0.38
CNR2 P34972 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 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
Methacrylic Acid SCHEMBL27594680 0.90 ALDH1A1 (0.43) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL1666500 0.90 CES2 (0.48) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28118587 0.90 CES2 (0.48) ALDH1A1KDM4ELMNARAB9AMAPT
Hydrochloric Acid SCHEMBL28053659 0.87 CES2 (0.45) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28321505 0.86 L3MBTL1 (0.41) ALDH1A1KDM4ELMNARAB9AMAPT
Methacrylic Acid SCHEMBL28211144 0.85 ALDH1A1 (0.39) ALDH1A1KDM4ELMNARAB9AMAPT
Methacrylic Acid SCHEMBL28064404 0.85 CES2 (0.42) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28227538 0.84 RAB9A (0.42) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL28327231 0.84 ALDH1A1 (0.43) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL29189525 0.83 ALDH1A1 (0.40) ALDH1A1KDM4ELMNARAB9AMAPT

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
CN-102540711-B Color composition for color filter, color filter, display element and pigment dispersing liquid for colour filter JSR株式会社 2016-08-24 CN disclosed