SCHEMBL8000165

SCHEMBL8000165

Cc1ccc(C(=S)c2ccc(Cc3c(Cl)cc(NN=Cc4ccccc4)cc3Cl)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
MAPT P10636 9/20 0.37
ALDH1A1 P00352 4/20 0.37
LMNA P02545 4/20 0.37
RAB9A P51151 3/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 4/20 0.36
GAA P10253 2/20 0.36
HSP90AA1 P07900 1/20 0.36
FFAR1 O14842 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
NPC1 O15118 2/20 0.35
POLB P06746 2/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
THRB P10828 1/20 0.35
HTT P42858 2/20 0.35
NOX1 Q9Y5S8 1/20 0.34

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
SCHEMBL7998767 0.89 KMT2A (0.42) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL7998769 0.89 KMT2A (0.42) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL8002208 0.79 NPC1 (0.40) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL8002204 0.79 NPC1 (0.40) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL7843652 0.79 LMNA (0.46) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL7843648 0.79 LMNA (0.46) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL8005183 0.78 KMT2A (0.39) KMT2AMAPTRAB9AHPGDL3MBTL1
SCHEMBL8005181 0.78 KMT2A (0.39) KMT2AMAPTRAB9AHPGDL3MBTL1
SCHEMBL8002014 0.77 NPC1 (0.37) KMT2AMAPTALDH1A1LMNARAB9A
SCHEMBL8000137 0.77 MAPT (0.39) KMT2AMAPTALDH1A1LMNARAB9A

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