SCHEMBL14161997

SCHEMBL14161997

C=C(/C=C(\NN)C1CC1)Nc1cc(OCCN2CCOCC2)nc(NCc2cc(C(C)C)no2)n1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 19/20 0.60
SLC5A7 Q9GZV3 1/20 0.43

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
SCHEMBL12438432 0.94 IGF1R (0.59) IGF1R
SCHEMBL14162073 0.86 IGF1R (0.58) IGF1R
SCHEMBL12438434 0.85 IGF1R (0.59) IGF1R
SCHEMBL12439402 0.85 IGF1R (0.58) IGF1R
SCHEMBL14050466 0.84 IGF1R (0.60) IGF1RSLC5A7
SCHEMBL12438050 0.82 IGF1R (0.62) IGF1RSLC5A7
SCHEMBL12439872 0.78 IGF1R (0.58) IGF1R
SCHEMBL14162069 0.78 IGF1R (0.63) IGF1R
SCHEMBL12439804 0.77 IGF1R (0.59) IGF1R
SCHEMBL12437973 0.77 IGF1R (0.60) IGF1R

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-2008076415-A1 METHODS OF USING MEK INHIBITORS EXELIXIS, INC. (US) 2008-06-26 WO disclosed