SCHEMBL7987235

SCHEMBL7987235

CCCc1nc(O)c2c(ncn2CCCc2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
CNOT7 Q9UIV1 8/20 0.44
TLR7 Q9NYK1 1/20 0.39
ADORA2A P29274 3/20 0.38
TMIGD3 P0DMS9 2/20 0.38
ADORA1 P30542 2/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TLR8 Q9NR97 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CTSL P07711 1/20 0.36

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
SCHEMBL7974254 0.93 TSHR (0.46) TSHRKDM4ELMNAPOLBMAPK1
SCHEMBL7985082 0.93 HTT (0.46) TSHRLMNACNOT7ADORA2AHTT
SCHEMBL7988857 0.89 CNOT7 (0.43) TSHRKDM4ELMNAPOLBMAPK1
SCHEMBL7984944 0.87 CNOT7 (0.44) TSHRKDM4ELMNAPOLBMAPK1
Hydrochloric Acid SCHEMBL7988006 0.86 CNOT7 (0.43) TSHRKDM4ELMNAPOLBMAPK1
SCHEMBL7989407 0.86 HPGD (0.44) TSHRPOLBCNOT7HTTALDH1A1
SCHEMBL7974534 0.85 CNOT7 (0.45) TSHRCNOT7ADORA2AHTTALDH1A1
SCHEMBL7987609 0.83 PDE4A (0.43) POLBALDH1A1KMT2A
SCHEMBL7989566 0.82 HPGD (0.41) POLBCNOT7ALDH1A1KMT2A
SCHEMBL7984242 0.81 CNOT7 (0.45) TSHRKDM4ELMNAPOLBMAPK1

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-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed