SCHEMBL26819142

SCHEMBL26819142

c1ccc(-c2nc(-c3ccccc3)c3c(n2)sc2ccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)cc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 8/20 0.39
▸ ADORA1 P30542 7/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ ATM Q13315 1/20 0.38
▸ HPGD P15428 4/20 0.37
▸ LIMK1 P53667 1/20 0.34
▸ RAB9A P51151 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ WHR1 P49842 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL26819897 0.96 ADORA2A (0.39) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL26818992 0.96 ADORA2A (0.36) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL16902233 0.93 ADORA2A (0.36) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL18370710 0.93 ADORA2A (0.39) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL18370709 0.93 ADORA2A (0.39) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL16902216 0.93 ADORA2A (0.36) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL19106413 0.91 ADORA2A (0.36) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL19106436 0.91 ADORA2A (0.39) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL26819540 0.91 MEN1 (0.39) ADORA2AADORA1MEN1KMT2AATM
SCHEMBL19106395 0.91 MEN1 (0.39) ADORA2AADORA1MEN1KMT2AATM

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
US-20230389344-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2023-11-30 — — US disclosed
US-20230389344-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2023-11-30 — — US disclosed
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