SCHEMBL24924237

SCHEMBL24924237

COc1cc(-c2nc(-c3ccccc3Cl)n(C3(c4ccccc4Cl)N=C(c4ccc(OC)c(OC)c4)C(c4ccccc4Cl)=N3)c2-c2ccccc2Cl)ccc1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.38
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 2/20 0.38
TP53 P04637 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PDE4A P27815 1/20 0.36
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
ADORA1 P30542 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
KDM4E B2RXH2 2/20 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
SCHEMBL29895743 0.93 L3MBTL1 (0.43) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL22710269 0.93 L3MBTL1 (0.43) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL8089682 0.88 L3MBTL1 (0.45) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL29895740 0.86 L3MBTL1 (0.43) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL16365751 0.86 L3MBTL1 (0.43) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL20464140 0.86 L3MBTL1 (0.44) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL25808949 0.85 PDCD1 (0.38) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL25778191 0.85 ALDH1A1 (0.38) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL29990970 0.82 L3MBTL1 (0.41) ALDH1A1L3MBTL1NPC1TP53RAB9A
SCHEMBL16355181 0.82 L3MBTL1 (0.43) ALDH1A1L3MBTL1NPC1TP53RAB9A

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
US-20230034267-A1 PHOTOSENSITIVE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-02-02 US disclosed