SCHEMBL23399103

SCHEMBL23399103

Cc1cccc(-n2nc(O)c(-c3ccccc3)c2-c2ccccc2C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 2/20 0.49
MAPT P10636 2/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 2/20 0.39

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
SCHEMBL23402741 0.94 RPA1 (0.43) RPA1MAPTUSP2LMNAPOLB
SCHEMBL23399539 0.90 HIF1A (0.44) RPA1MAPTUSP2LMNAPOLB
SCHEMBL23399608 0.88 RPA1 (0.51) RPA1LMNAALDH1A1L3MBTL1IDO1
SCHEMBL23401472 0.87 RPA1 (0.50) RPA1MAPTLMNATSHRNPSR1
SCHEMBL23403035 0.86 MEN1 (0.41) MAPTLMNAALDH1A1L3MBTL1NPC1
SCHEMBL23402309 0.86 NPC1 (0.42) MAPTLMNAPOLBTSHRALDH1A1
SCHEMBL23402024 0.85 RPA1 (0.48) RPA1MAPTLMNAALDH1A1L3MBTL1
SCHEMBL23399436 0.85 RPA1 (0.48) RPA1MAPTLMNAALDH1A1L3MBTL1
SCHEMBL23400946 0.84 RPA1 (0.44) RPA1MAPTUSP2LMNAPOLB
SCHEMBL23398999 0.83 NPC1 (0.51) RPA1MAPTLMNATSHRNPSR1

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed