SCHEMBL8000233

SCHEMBL8000233

O=C(c1ccc(Cc2c(Cl)cc(N3N=CCNC3=O)cc2Cl)cc1)c1ccnc(Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 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
SCHEMBL8002345 0.90 AR (0.30)
SCHEMBL8002706 0.90 LSS (0.34)
SCHEMBL7470125 0.89 VNN1 (0.34) KDM4AKDM4CKDM5B
SCHEMBL7990339 0.88 PARP1 (0.34)
SCHEMBL8005703 0.88 CYP19A1 (0.33) KDM4AKDM4CKDM5B
SCHEMBL8001979 0.87 SRD5A2 (0.40)
SCHEMBL7999035 0.85 KMT2A (0.34)
SCHEMBL7999106 0.85 CCR9 (0.33)
SCHEMBL8002443 0.83 MAPT (0.34)
SCHEMBL7839566 0.83 KMT2A (0.39)

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