SCHEMBL8002255

SCHEMBL8002255

O=C1NCC=NN1c1cc(Cl)c(Cc2ccc(C(O)c3cc4ccccc4[nH]3)cc2)c(Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.32
PIK3CA P42336 1/20 0.32
IL4I1 Q96RQ9 2/20 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
SCHEMBL8005151 0.84
SCHEMBL7990341 0.83 ALDH1A1 (0.33)
SCHEMBL8004871 0.82 MAPT (0.37)
SCHEMBL8002032 0.82 LMNA (0.43)
SCHEMBL8002451 0.81 MAP2K1 (0.41) EGFRPIK3CA
SCHEMBL8001913 0.80 TSHR (0.34) EGFR
SCHEMBL7989885 0.80 S1PR1 (0.33)
SCHEMBL7990240 0.79
SCHEMBL7998640 0.79 ALDH1A1 (0.30)
SCHEMBL7480508 0.79 TYMP (0.35)

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