SCHEMBL4729802

SCHEMBL4729802

COc1ccc(NC(=S)NC2CCN(c3nncc4ccc(Br)cc34)CC2)cc1.Cc1ccc(NC(=S)NC2CCN(c3nncc4ccc(Br)cc34)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.46
KDR P35968 1/20 0.46

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
SCHEMBL4583673 0.97 EGFR (0.48) EGFRKDR
SCHEMBL4582514 0.94 SMN1; SMN2 (0.46)
SCHEMBL4583945 0.90 EGFR (0.46) EGFRKDR
SCHEMBL4584112 0.87 MAPT (0.44)
SCHEMBL4583133 0.87 SMN1; SMN2 (0.46)
SCHEMBL4584003 0.86 MEN1 (0.51)
SCHEMBL4582536 0.85 KMT2A (0.48) EGFRKDR
SCHEMBL4584224 0.84 SMN1; SMN2 (0.42)
SCHEMBL4779982 0.84 ALDH1A1 (0.44)
SCHEMBL4582338 0.83 SMN1; SMN2 (0.42)

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
WO-2008028690-A1 1-(HET)ARYL-3-[HETARYL-PIPERIDIN-4-YL]-THIOUREAS AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-03-13 WO claimed