SCHEMBL6426140

SCHEMBL6426140

Cn1ncc(OC(N)=O)c1N

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 1/20 0.31
RIPK2 O43353 1/20 0.30
F2 P00734 1/20 0.30
PI4KA P42356 1/20 0.30
PI4K2B Q8TCG2 1/20 0.30
PI4K2A Q9BTU6 1/20 0.30
PI4KB Q9UBF8 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL27625231 0.81 ALOX15 (0.36) NPC1RAB9AKMT2AMEN1HPGD
SCHEMBL28559658 0.80 KDM4E (0.34) KMT2AMEN1
SCHEMBL28847404 0.80 HTT (0.34)
SCHEMBL18209664 0.77 POLB (0.37)
SCHEMBL6065184 0.76 TSHR (0.33) NPC1
SCHEMBL1831743 0.74 ALDH1A1 (0.31) KMT2AMEN1PI4KAPI4K2BPI4K2A
SCHEMBL19313103 0.74
SCHEMBL18209671 0.73 ALOX5 (0.33)
SCHEMBL1456373 0.73 RAB9A (0.56) NPC1RAB9AKMT2ARIPK2HPGD
Hydrochloric Acid SCHEMBL29907682 0.72 GAA (0.36) KMT2AMEN1PI4KAPI4K2BPI4K2A

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
EP-1556389-A1 CEPHEM COMPOUNDS Astellas Pharma Inc. (JP) 2005-07-27 EP disclosed
WO-2004039814-A1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC. (JP) 2004-05-13 WO disclosed