SCHEMBL23320412

SCHEMBL23320412

CC(c1cnco1)N(C(N)=O)c1ccc2cn(-c3ccccc3)nc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NAMPT P43490 1/20 0.38
▸ ESR2 Q92731 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ PARP2 Q9UGN5 1/20 0.35
▸ PARP3 Q9Y6F1 1/20 0.35
▸ ADORA3 P0DMS8 7/20 0.35
▸ ITK Q08881 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ PKM P14618 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ ALOX15 P16050 1/20 0.32

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
SCHEMBL23320562 0.78 NAMPT (0.40) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL23320410 0.76 NAMPT (0.39) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL23320378 0.73 ADORA3 (0.37) MEN1KMT2ANPC1LMNARAB9A
SCHEMBL17112018 0.67 MAPT (0.55) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL23320568 0.66 SCN9A (0.33) MAPTNAMPTADORA3KDM4EPKM
SCHEMBL23320451 0.64 NAMPT (0.69) NAMPT
SCHEMBL15910787 0.62 MAPT (0.57) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL20765774 0.59 PARP1 (0.52) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL23320366 0.59 NAMPT (0.66) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL23320550 0.59 NPC1 (0.57) MEN1KMT2ANPC1LMNAMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3818053-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-05-12 — — EP disclosed
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