SCHEMBL7987690

SCHEMBL7987690

NC(=O)c1c(N)ncn1Cc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.43
GAA P10253 2/20 0.42
TSHR P16473 1/20 0.42
MAPK14 Q16539 2/20 0.42
CYP11B2 P19099 3/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GRM2 Q14416 2/20 0.40
CYP11B1 P15538 2/20 0.40
RAB9A P51151 1/20 0.40
QPCT Q16769 2/20 0.39
QPCTL Q9NXS2 1/20 0.39
MAOB P27338 1/20 0.39
PARP10 Q53GL7 1/20 0.39
MET P08581 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL7987743 0.87 SCD (0.50) PKMGAATSHRCYP11B2HTT
SCHEMBL2145385 0.85 PKM (0.43) PKMGAATSHRMAPK14CYP11B2
SCHEMBL7988530 0.85 SMN1; SMN2 (0.46) PKMGAATSHRCYP11B2HTT
SCHEMBL18050897 0.85 PKM (0.49) PKMGAATSHRMAPK14CYP11B2
SCHEMBL5483136 0.85 PKM (0.59) PKMGAATSHRCYP11B2CYP11B1
SCHEMBL7991370 0.85 KDM4E (0.51) PKMGAATSHRSMN1; SMN2QPCT
Hydrochloric Acid SCHEMBL7987445 0.84 PKM (0.57) PKMGAATSHRCYP11B2CYP11B1
SCHEMBL7974168 0.83 CDK9 (0.45) PKMGAATSHRMAPK14CYP11B2
SCHEMBL7984484 0.83 PKM (0.50) PKMGAATSHRCYP11B2HTT
Hydrochloric Acid SCHEMBL7991220 0.82 PKM (0.42) PKMGAATSHRCYP11B1

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