SCHEMBL7985129

SCHEMBL7985129

COC(=O)c1ccc(Cn2cnc(N)c2C(N)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.50
CYP11B2 P19099 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.47
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.45
RAB9A P51151 1/20 0.45
BRD4 O60885 1/20 0.44
TLR7 Q9NYK1 1/20 0.44
EP300 Q09472 3/20 0.44
MMP13 P45452 1/20 0.43
FAAH O00519 1/20 0.43

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
SCHEMBL7987441 0.84 MEN1 (0.49) CYP11B2GAARAB9AMMP13
SCHEMBL7988530 0.82 SMN1; SMN2 (0.46) CYP11B2LMNAGAARAB9A
SCHEMBL7986400 0.81 YTHDC1 (0.47) YTHDC1CYP11B2LOXL2LMNAGAA
SCHEMBL7987743 0.81 SCD (0.50) CYP11B2LMNAGAA
SCHEMBL2183153 0.81 L3MBTL1 (0.48) CYP11B2GAAMMP13
SCHEMBL7987690 0.80 PKM (0.43) CYP11B2LMNAGAARAB9A
SCHEMBL7987245 0.80 ROCK2 (0.47) LMNA
SCHEMBL5483136 0.79 PKM (0.59) CYP11B2LMNAGAA
SCHEMBL7975121 0.79 ABCC8 (0.47) CYP11B2GAA
Hydrochloric Acid SCHEMBL7987445 0.78 PKM (0.57) CYP11B2LMNAGAA

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