SCHEMBL18848482

SCHEMBL18848482

Ic1cc2cccc(I)c2cn1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.38
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
EGLN1 Q9GZT9 1/20 0.32
MIF P14174 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
SCHEMBL18848565 0.83 NOS1 (0.38) NOS1MIF
SCHEMBL18848569 0.80 CYP1A2 (0.47) IDO1TDO2
SCHEMBL29909738 0.80 PDPK1 (0.53) NOS1IDO1TDO2
SCHEMBL26873301 0.78 ALDH1A1 (0.52)
SCHEMBL17977189 0.74 DDT (0.43) IDO1TDO2EGLN1MIF
SCHEMBL16723362 0.74 ALDH1A1 (0.43) NOS1
SCHEMBL4238751 0.73 CYP1A2 (0.54) MIF
SCHEMBL23762061 0.72 HTR3A (0.45)
SCHEMBL15768897 0.72 ALDH1A1 (0.40) NOS1
SCHEMBL30838410 0.72 ALDH1A1 (0.40) NOS1

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-20170133599-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-11 US disclosed