SCHEMBL7988946

SCHEMBL7988946

NCCc1nc(=O)c2c(ncn2CCc2ccccc2)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 11/20 0.56
ALDH1A1 P00352 1/20 0.44
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
PARN O95453 1/20 0.41
HTT P42858 1/20 0.40
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
MEN1 O00255 1/20 0.39
RGS12 O14924 1/20 0.39
USP2 O75604 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
PNP P00491 2/20 0.39
ADORA2A P29274 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
SCHEMBL7988863 0.93 CNOT7 (0.57) CNOT7ALDH1A1KDM4ELMNAPOLB
SCHEMBL7985640 0.89 CNOT7 (0.53) CNOT7ALDH1A1POLBPARNKMT2A
SCHEMBL7985085 0.88 CNOT7 (0.56) CNOT7ALDH1A1KDM4ELMNAPOLB
Hydrochloric Acid SCHEMBL7987619 0.88 CNOT7 (0.52) CNOT7ALDH1A1POLBPARNKMT2A
SCHEMBL7974538 0.87 CNOT7 (0.57) CNOT7ALDH1A1KDM4ELMNAPOLB
SCHEMBL7984710 0.85 CNOT7 (0.55) CNOT7ALDH1A1KDM4ELMNAPOLB
Hydrochloric Acid SCHEMBL7984353 0.84 CNOT7 (0.54) CNOT7ALDH1A1KDM4ELMNAPOLB
SCHEMBL7985323 0.82 CNOT7 (0.51) CNOT7ALDH1A1POLBPARNKMT2A
SCHEMBL7987237 0.81 CNOT7 (0.57) CNOT7ALDH1A1KDM4ELMNAPOLB
Hydrochloric Acid SCHEMBL7987750 0.81 CNOT7 (0.50) CNOT7ALDH1A1POLBPARNKMT2A

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