SCHEMBL7974304

SCHEMBL7974304

NCCc1nc(O)c2c(ncn2Cc2ccc(F)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.44
TAAR1 Q96RJ0 1/20 0.37
CYP11B2 P19099 3/20 0.36
CYP11B1 P15538 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
QPCT Q16769 2/20 0.35
QPCTL Q9NXS2 1/20 0.35
MAOB P27338 1/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SOS1 Q07889 1/20 0.33
GRM2 Q14416 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL7988957 0.89 MET (0.45) METCYP11B2CYP11B1SMN1; SMN2HTT
SCHEMBL7975137 0.88 LMNA (0.42) METTAAR1CYP11B2CYP11B1SMN1; SMN2
SCHEMBL7985637 0.88 SMN1; SMN2 (0.43) CYP11B2CYP11B1SMN1; SMN2ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL7987616 0.86 SMN1; SMN2 (0.42) CYP11B2CYP11B1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL7988533 0.86 TAAR1 (0.43) TAAR1CYP11B2CYP11B1MAOB
SCHEMBL7984526 0.85 MET (0.46) METCYP11B2CYP11B1SMN1; SMN2HTT
SCHEMBL7985639 0.85 ABCC8 (0.44) METCYP11B2CYP11B1
SCHEMBL7985513 0.82 MET (0.43) METCYP11B2CYP11B1SMN1; SMN2HTT
SCHEMBL7974295 0.82 LMNA (0.40) TAAR1ALDH1A1MEN1KMT2A
SCHEMBL7988674 0.81 SMN1; SMN2 (0.43) TAAR1CYP11B2CYP11B1SMN1; SMN2HTT

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