SCHEMBL7998519

SCHEMBL7998519

COC(CNC(=O)N(/N=C/c1ccccc1)c1cc(Cl)c(Sc2ccc(C(=O)c3ccc(Cl)nc3)cc2)c(Cl)c1)OC

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 3/20 0.31
GAA P10253 2/20 0.31
KDM4E B2RXH2 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL7998524 1.00 L3MBTL1 (0.32) L3MBTL1ALDH1A1GAAKDM4EOPRM1
SCHEMBL8000238 0.87 LMNA (0.34) L3MBTL1ALDH1A1GAAKDM4EKMT2A
SCHEMBL8000241 0.87 LMNA (0.34) L3MBTL1ALDH1A1GAAKDM4EKMT2A
SCHEMBL8002325 0.85 KDM4E (0.33) L3MBTL1ALDH1A1GAAKDM4EKMT2A
SCHEMBL8002328 0.85 KDM4E (0.33) L3MBTL1ALDH1A1GAAKDM4EKMT2A
SCHEMBL8001911 0.84 LMNA (0.32) L3MBTL1ALDH1A1KDM4EKMT2ANPC1
SCHEMBL8001906 0.84 LMNA (0.32) L3MBTL1ALDH1A1KDM4EKMT2ANPC1
SCHEMBL7830131 0.74 LMNA (0.35) L3MBTL1ALDH1A1GAAKDM4EKMT2A
SCHEMBL7998973 0.74 GAA (0.39) L3MBTL1ALDH1A1GAAKDM4EKMT2A
SCHEMBL7998975 0.74 GAA (0.39) L3MBTL1ALDH1A1GAAKDM4EKMT2A

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
US-6294536-B1 CONTROL OF PROTOZOA AND REDUCTION IN THE INCIDENCE OF ASSOCIATED DISEASES AND DEATH AND CONSEQUENT IMPROVEMENT IN RETARDED GROWTH AND GENERAL CONDITION AND PREVENTING DECREASE GROWTH AND GENERAL CONDITION TAKEDA SCHERING-PLOUGH ANIMAL HEALTH K.K. (JP) 2001-09-25 US disclosed