SCHEMBL8059199

SCHEMBL8059199

Ic1ccc(NCc2ccc(CNc3ccc(I)cc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.59
EPAS1 Q99814 1/20 0.59
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
MAPT P10636 4/20 0.50
GAA P10253 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.50
HPGD P15428 2/20 0.50
ALOX15 P16050 2/20 0.50
MAPK1 P28482 2/20 0.50
CASP1 P29466 2/20 0.50
BLM P54132 2/20 0.50
HSD17B10 Q99714 2/20 0.50
AGER Q15109 1/20 0.50
KDM4E B2RXH2 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
THRB P10828 1/20 0.50

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
SCHEMBL4513303 0.89 HTT (0.64) HIF1AEPAS1MEN1KMT2AMAPT
SCHEMBL3801479 0.88 FFAR1 (0.53) HIF1AEPAS1MEN1KMT2AMAPT
SCHEMBL4509418 0.85 KDM4E (0.53) HIF1AEPAS1MAPTGAAALDH1A1
SCHEMBL4385091 0.79 CA1 (0.75) HIF1AMEN1KMT2AMAPTL3MBTL1
SCHEMBL32665122 0.78 CA1 (0.47) HIF1AEPAS1MEN1KMT2AMAPT
SCHEMBL11172866 0.76 CXCR3 (0.52) MEN1KMT2AALDH1A1CYP1A2CYP3A4
SCHEMBL11528091 0.76 MAPT (0.55) HIF1AEPAS1MAPTGAAL3MBTL1
SCHEMBL2005375 0.75 MAPT (0.80) MEN1KMT2AMAPTGAAL3MBTL1
SCHEMBL10055033 0.75 LMNA (0.61) MEN1KMT2AMAPTGAAL3MBTL1
SCHEMBL6419238 0.75 LMNA (0.61) MEN1KMT2AMAPTGAAL3MBTL1

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
US-6143917-A FROM A DIARYL CARBONATE AND AN AMINE COMPOUND HAVING AT LEAST ONE HYDROGEN ATOM LOCATED AT AN N-POSITION UNDER MODERATE CONDITIONS AT A HIGH REACTION RATE WITH A HIGH SELECTIVITY AND WITH A HIGH YIELD UBE INDUSTRIES, LTD. (JP) 2000-11-07 US disclosed
EP-0902014-A1 PROCESS FOR PRODUCING ARYL CARBAMATES UBE INDUSTRIES LIMITED (JP) 1999-03-17 EP disclosed