SCHEMBL9360657

SCHEMBL9360657

CCCCCCOC(=O)/C(=C\C(N)=O)c1cccc(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
TSHR P16473 5/20 0.46
LMNA P02545 5/20 0.46
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
CYP3A4 P08684 2/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 5/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42
CHRM2 P08172 1/20 0.42
ADRA2A P08913 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
L3MBTL1 Q9Y468 4/20 0.39

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
SCHEMBL9364427 0.85 GPR35 (0.43) ALDH1A1TSHRLMNAHSD17B10KDM4E
SCHEMBL9364403 0.82 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10KDM4E
SCHEMBL9364399 0.82 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10KDM4E
SCHEMBL9359700 0.78 ALDH1A1 (0.47) ALDH1A1TSHRLMNATP53MAPT
SCHEMBL9359707 0.78 ALDH1A1 (0.47) ALDH1A1TSHRLMNATP53MAPT
SCHEMBL9359888 0.78 LMNA (0.49) ALDH1A1TSHRLMNAHSD17B10KDM4E
SCHEMBL9359884 0.78 LMNA (0.49) ALDH1A1TSHRLMNAHSD17B10KDM4E
SCHEMBL9360086 0.74 ALDH1A1 (0.48) ALDH1A1TSHRLMNACYP3A4TP53
SCHEMBL9360090 0.74 ALDH1A1 (0.48) ALDH1A1TSHRLMNACYP3A4TP53
SCHEMBL9363967 0.72 TSHR (0.55) ALDH1A1TSHRLMNAKDM4EKMT2A

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
EP-0393713-B1 Process for the preparation of N-substituted maleimides TOSOH CORP (JP) 1994-06-29 EP disclosed
US-5087705-A Heating N-substituted maleamic acid monoester in presence of acid catalyst SHIN-DAIKYOWA PETROCHEMICAL CO., LTD. (JP) 1992-02-11 US disclosed
EP-0393713-A1 Process for the preparation of N-substituted maleimides Tosoh Corporation (JP) 1990-10-24 EP disclosed