SCHEMBL9874042

SCHEMBL9874042

O=C(O)c1cccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.51
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.46
CD74 P04233 1/20 0.45
MIF P14174 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
KEAP1 Q14145 1/20 0.44
MAOA P21397 1/20 0.44
BLVRB P30043 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
DDT P30046 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL9340148 0.87 ALDH1A1 (0.39) KMORXRARXRBNPC1RAB9A
SCHEMBL13901177 0.83 ALOX15 (0.41) SMN1; SMN2KDM4EALDH1A1HPGDMAPK1
SCHEMBL28069322 0.82 KMO (0.67) KMORXRARXRBNPC1RAB9A
SCHEMBL7747047 0.82 SDHB (0.50) NPC1RAB9AL3MBTL1
SCHEMBL1936088 0.80 TSHR (0.44) RXRARXRBNPC1RAB9ASMN1; SMN2
SCHEMBL9873206 0.79 TP53 (0.48) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL9871024 0.77 PIM2 (0.49) L3MBTL1SMN1; SMN2KDM4EALDH1A1HDAC6
SCHEMBL9871021 0.77 PIM2 (0.49) L3MBTL1SMN1; SMN2KDM4EALDH1A1HDAC6
SCHEMBL80527 0.77 MEN1 (0.47) NPC1RAB9AL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL4900598 0.77 MEN1 (0.47) NPC1RAB9AL3MBTL1SMN1; SMN2ALDH1A1

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
JP-2004782-A None JP disclosed
US-5064959-A Photoinitiators HOECHST AKTIENGESELLSCHAFT (DE) 1991-11-12 US disclosed
JP-H024782-A AROMATIC COMPOUND, ITS PRODUCTION AND PHOTOINITIATOR COMPRISING THE COMPOUND IN PHOTOSENSITIVE MIXTURE HOECHST AG 1990-01-09 JP disclosed