SCHEMBL28219396

SCHEMBL28219396

O=C(O)COc1cccc(Cl)c1Cl.[Zn]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.62
PTGDR2 Q9Y5Y4 4/20 0.58
MRGPRX4 Q96LA9 1/20 0.54
TDP1 Q9NUW8 3/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GLA P06280 1/20 0.51
HTR1D P28221 2/20 0.49
MAPT P10636 1/20 0.48
GAA P10253 1/20 0.48
CASP1 P29466 1/20 0.48
PPARG P37231 1/20 0.48
CASP7 P55210 1/20 0.48
NCOA2 Q15596 1/20 0.48
NCOA1 Q15788 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL692136 0.98 KMT2A (0.65) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
Water SCHEMBL28856010 0.96 KMT2A (0.62) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
SCHEMBL27744360 0.96 KMT2A (0.62) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
Ammonia Solution, Strong SCHEMBL27869911 0.96 KMT2A (0.62) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
SCHEMBL27372722 0.96 KMT2A (0.62) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
Alcohol SCHEMBL28150988 0.93 KMT2A (0.59) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
2,4-Dichlorophenoxyacetic Acid SCHEMBL27670713 0.86 TDP1 (0.77) KMT2APTGDR2MRGPRX4TDP1SMN1; SMN2
SCHEMBL28199503 0.84 TDP1 (0.59) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
SCHEMBL9722695 0.84 MRGPRX4 (0.51) KMT2APTGDR2MRGPRX4TDP1ALDH1A1
SCHEMBL101520 0.83 PTGDR2 (0.68) KMT2APTGDR2TDP1ALDH1A1KDM4E

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-110520452-A (meth) acrylic copolymer, method for producing same, resin composition, and antifouling coating composition MITSUBISHI CHEM CORP 2019-11-29 CN disclosed
CN-110506064-A (meth) acrylic copolymer, method for producing same, resin composition, and antifouling coating composition MITSUBISHI CHEM CORP 2019-11-26 CN disclosed
CN-108137760-A (meth) acrylic copolymer, polymer solution, polymer-containing composition, antifouling coating composition, and method for producing (meth) acrylic copolymer 三菱化学株式会社 2018-06-08 CN disclosed