SCHEMBL7992368

SCHEMBL7992368

CCC(=O)Nc1ncn(Cc2cccc(OC)c2)c1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
ADRA1D P25100 1/20 0.46
MTNR1A P48039 4/20 0.45
MTNR1B P49286 4/20 0.45
YTHDC1 Q96MU7 1/20 0.45
PTGER3 P43115 1/20 0.45
NR3C2 P08235 1/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPK8 P45983 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 1/20 0.42
LPO P22079 1/20 0.42

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
SCHEMBL7987961 0.86 MAPT (0.47) TP53RXFP1ADRA1DYTHDC1NR3C2
SCHEMBL7985340 0.86 NTRK1 (0.51) ADRA1DMAPTMEN1KMT2ARAB9A
SCHEMBL7985670 0.85 CDK9 (0.42) YTHDC1NR3C2MAPTKMT2AMAPK8
SCHEMBL7974162 0.85 KDM4E (0.52) TP53RXFP1ADRA1DYTHDC1MAPT
SCHEMBL7985508 0.85 ALDH1A1 (0.43) MEN1KMT2A
SCHEMBL7991565 0.84 TSHR (0.49) ADRA1DYTHDC1KMT2A
SCHEMBL7986281 0.83 KMT2A (0.39) MTNR1AMTNR1BYTHDC1MAPTKMT2A
SCHEMBL7987598 0.83 RIOK2 (0.41) YTHDC1MEN1KMT2AMAPK8RAB9A
SCHEMBL7974433 0.83 TP53 (0.40) TP53RXFP1ADRA1DYTHDC1PTGER3
SCHEMBL7988637 0.82 NPC1 (0.51) TP53ADRA1DYTHDC1PTGER3MAPT

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