SCHEMBL8002328

SCHEMBL8002328

COC(CNC(=O)N(N=Cc1ccccc1)c1cc(C)c(Cc2ccc(C(=O)c3ccc(Cl)nc3)cc2)c(Cl)c1)OC

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 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
SCHEMBL8002325 1.00 KDM4E (0.33) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL8000238 0.96 LMNA (0.34) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL8000241 0.96 LMNA (0.34) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL8001906 0.92 LMNA (0.32) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL8001911 0.92 LMNA (0.32) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL7998519 0.85 L3MBTL1 (0.32) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL7998524 0.85 L3MBTL1 (0.32) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL7830131 0.83 LMNA (0.35) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL8005622 0.83 SRD5A2 (0.36) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2
SCHEMBL8005624 0.83 SRD5A2 (0.36) KDM4EALDH1A1LMNAL3MBTL1SMN1; SMN2

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
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
WO-1999011634-A1 TRIAZINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-11 WO disclosed