SCHEMBL23320410

SCHEMBL23320410

NC(=O)N(CCc1cnco1)c1ccc2cn(-c3ccccc3)nc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.39
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ESR2 Q92731 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ PARP2 Q9UGN5 1/20 0.34
▸ PARP3 Q9Y6F1 1/20 0.34
▸ ADORA3 P0DMS8 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ITK Q08881 1/20 0.32
▸ MIF P14174 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31

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 0.90 NAMPT (0.40) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL23320412 0.76 MEN1 (0.39) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL23320379 0.72 NAMPT (0.41) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL23320451 0.71 NAMPT (0.69) NAMPT
SCHEMBL17112018 0.66 MAPT (0.55) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL23320566 0.66 NAMPT (0.35) NAMPTMAPTMEN1KMT2AADORA3
SCHEMBL23320352 0.65 NAMPT (0.42) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL27157148 0.64 CASP3 (0.43) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL23320550 0.64 NPC1 (0.57) NAMPTMAPTMEN1NPC1LMNA
SCHEMBL15910787 0.61 MAPT (0.57) NAMPTMAPTMEN1NPC1LMNA

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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