SCHEMBL7205874

SCHEMBL7205874

Nc1nc(SCCF)nc2c1nc(O)n2Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
NPSR1 Q6W5P4 2/20 0.42
TSHR P16473 2/20 0.42
ADORA3 P0DMS8 2/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 1/20 0.40
ABCB1 P08183 1/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
PNP P00491 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
TLR7 Q9NYK1 1/20 0.38

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
SCHEMBL7206458 0.92 MAPK1 (0.45) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL7210239 0.91 ABCB1 (0.50) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL3874062 0.89 MAPK1 (0.56) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL7211816 0.88 TLR7 (0.44) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL7205405 0.87 MAPK1 (0.48) MAPK1NPSR1TSHRADORA3ABCB1
SCHEMBL7211567 0.87 TSHR (0.44) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL7208339 0.87 ADORA3 (0.48) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL10174463 0.86 L3MBTL1 (0.48) MAPK1NPSR1TSHRADORA3ALDH1A1
SCHEMBL7208584 0.86 MAPK1 (0.47) MAPK1NPSR1TSHRADORA3ABCB1
SCHEMBL7205545 0.86 TLR7 (0.47) KMT2ATLR7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1035123-B1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMA (JP) 2003-08-20 EP disclosed
US-6329381-B1 INTERFERONS, VIRICIDES AND ANTICARCINOGENIC AGENTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-12-11 US disclosed
EP-1035123-A1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-09-13 EP disclosed