SCHEMBL16995458

SCHEMBL16995458

Cc1ccc(C)c(/C=N\c2cc(C(C)(C)C)cc(C(C)(C)C)c2I)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
LMNA P02545 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HTT P42858 1/20 0.38
DHODH Q02127 1/20 0.36
ALDH1A1 P00352 7/20 0.35
GAA P10253 3/20 0.35
PKM P14618 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 3/20 0.34
ALOX12 P18054 2/20 0.34
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MPI P34949 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL14337294 0.84 DHODH (0.45) MAPTLMNAKDM4EHTTDHODH
SCHEMBL14337437 0.73 MAPT (0.50) MAPTLMNAKDM4EHTTDHODH
SCHEMBL17594927 0.67 POLB (0.44) MAPTLMNAKDM4EALDH1A1POLB
SCHEMBL16080711 0.67 MAPT (0.74) MAPTLMNAKDM4EHTTDHODH
SCHEMBL21983921 0.66 MAPT (0.44) MAPTLMNAKDM4EHTTDHODH
SCHEMBL18859049 0.66 ALOX5 (0.52) MAPTLMNAKDM4EHTTDHODH
SCHEMBL22560742 0.65 GABRA1 (0.42) MAPTLMNAKDM4EHTTALDH1A1
SCHEMBL14337391 0.64 MAPT (0.57) MAPTLMNAKDM4EHTTDHODH
SCHEMBL10182423 0.64 ALOX5 (0.53) MAPTLMNAKDM4EHTTDHODH
SCHEMBL22763968 0.64 PTGS2 (0.53) MAPTLMNAKDM4EHTTALDH1A1

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
EP-1243598-B1 PROCESS FOR THE POLYMERIZATION OF OLEFINS MITSUI CHEMICALS INC (JP) 2015-08-12 EP disclosed