SCHEMBL8005181

SCHEMBL8005181

O=C(c1ccc(Cc2c(Cl)cc(N/N=C/c3ccccc3)cc2Cl)cc1)c1cnc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.39
GAA P10253 7/20 0.39
NPC1 O15118 7/20 0.39
RAB9A P51151 7/20 0.39
MEN1 O00255 6/20 0.39
POLB P06746 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSP90AA1 P07900 1/20 0.38
GFER P55789 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
MAPT P10636 6/20 0.37
TDP1 Q9NUW8 2/20 0.37
ADCYAP1R1 P41586 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37

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
SCHEMBL8005183 1.00 KMT2A (0.39) KMT2AGAANPC1RAB9AMEN1
SCHEMBL8002208 0.89 NPC1 (0.40) KMT2AGAANPC1RAB9AMEN1
SCHEMBL8002204 0.89 NPC1 (0.40) KMT2AGAANPC1RAB9AMEN1
SCHEMBL7483622 0.89 MEN1 (0.49) KMT2AGAANPC1RAB9AMEN1
SCHEMBL7483627 0.89 MEN1 (0.49) KMT2AGAANPC1RAB9AMEN1
SCHEMBL7998769 0.88 KMT2A (0.42) KMT2AGAANPC1RAB9AMEN1
SCHEMBL7998767 0.88 KMT2A (0.42) KMT2AGAANPC1RAB9AMEN1
SCHEMBL8000137 0.85 MAPT (0.39) KMT2AGAANPC1RAB9AMEN1
SCHEMBL7998535 0.85 NPC1 (0.39) KMT2AGAANPC1RAB9AMEN1
SCHEMBL7998534 0.85 NPC1 (0.39) KMT2AGAANPC1RAB9AMEN1

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