SCHEMBL456779

SCHEMBL456779

CCC1=CC=C(c2ccccc2)C[C]1I

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.31

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
SCHEMBL455340 0.79 TP53 (0.31) TP53
SCHEMBL458110 0.79 TP53 (0.31) TP53
SCHEMBL455859 0.76 APP (0.31)
SCHEMBL455217 0.74 SHMT2 (0.32) TP53
SCHEMBL455737 0.72 CYP1A2 (0.33)
SCHEMBL3982745 0.71 ALDH1A1 (0.47)
SCHEMBL455470 0.70 HPGD (0.32) TP53
SCHEMBL18808378 0.69 TP53 (0.36) TP53
SCHEMBL456712 0.69 HPGD (0.31)
SCHEMBL455952 0.68 APP (0.34)

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
EP-2614053-A1 METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-07-17 EP disclosed
WO-2012033225-A1 METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-15 WO disclosed