SCHEMBL28045958

SCHEMBL28045958

COc1cccc(N(Cl)C(=O)CC(C)=O)c1OC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.43
HPGD P15428 2/20 0.40
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 4/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
GLA P06280 1/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 2/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL28045981 0.82 MTNR1A (0.42) NFE2L2ALDH1A1KMT2AKDM4EGAA
SCHEMBL2975268 0.74 PAX8 (0.44) HPGDALDH1A1KMT2APOLBMEN1
SCHEMBL2028142 0.73 NFE2L2 (0.44) NFE2L2HPGDALDH1A1KMT2APOLB
SCHEMBL6841542 0.71 GAA (0.38) ALDH1A1KMT2AGAALMNAMEN1
SCHEMBL28046011 0.69 ALDH1A1 (0.55) NFE2L2ALDH1A1KMT2APOLBLMNA
SCHEMBL28454695 0.68 KDM4E (0.50) NFE2L2HPGDALDH1A1KMT2APOLB
SCHEMBL23967543 0.68 ALDH1A1 (0.45) NFE2L2HPGDALDH1A1KMT2APOLB
SCHEMBL2586902 0.67 CYP3A4 (0.53) NFE2L2ALDH1A1KMT2AKDM4ELMNA
Acetamide SCHEMBL9643066 0.67 NFE2L2 (0.53) NFE2L2HPGDALDH1A1KMT2APOLB
SCHEMBL5270439 0.67 SMN1; SMN2 (0.47) NFE2L2HPGDALDH1A1KMT2AKDM4E

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-105143353-B Disazo pigment composition and method for producing same 东洋油墨SC控股株式会社 2017-03-15 CN disclosed
CN-105143353-A Disazo pigment composition and method for producing same TOYO INK SC HOLDINGS CO LTD 2015-12-09 CN disclosed