SCHEMBL11429116

SCHEMBL11429116

CCCCCCCCCCCc1nc(-c2nc(N)nc(N)n2)c[nH]1.CCn1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 7/20 0.35
▸ USP2 O75604 2/20 0.34
▸ POLB P06746 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KEAP1 Q14145 1/20 0.34
▸ NFE2L2 Q16236 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PDE3B Q13370 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ PI4KA P42356 1/20 0.32
▸ PI4K2B Q8TCG2 1/20 0.32
▸ PI4K2A Q9BTU6 1/20 0.32
▸ PI4KB Q9UBF8 1/20 0.32
▸ SCN9A Q15858 2/20 0.31
▸ PDE4A P27815 2/20 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
SCHEMBL21409794 0.75 HTR2A (0.35) GPR84PKMHPGDPI4KAPI4K2B
SCHEMBL157393 0.74 NOS2 (0.36) ADORA2A
SCHEMBL16267855 0.70 BACE1 (0.32) —
SCHEMBL2157690 0.68 KDM4E (0.35) POLBMAPTADORA2A
SCHEMBL10724899 0.66 CASP1 (0.50) GPR84SCN9ASCN5A
SCHEMBL546259 0.65 CASP1 (0.38) GPR84PKMHPGDPI4KAPI4K2B
SCHEMBL16460924 0.65 CASP1 (0.38) GPR84PKMHPGDPI4KAPI4K2B
SCHEMBL8016347 0.64 TLR8 (0.47) USP2MEN1MAPTKMT2AHPGD
SCHEMBL4374043 0.64 PI4KA (0.44) GPR84PKMHPGDPI4KAPI4K2B
SCHEMBL7850079 0.63 GPR84 (0.38) GPR84PKMHPGD

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-4205156-A Novel imidazole-isocyanuric acid adducts and utilization thereof SHIKOKU CHEMICALS CORPORATION (JP) 1980-05-27 — — US disclosed
US-4189577-A CURING AGENTS FOR EPOXY RESINS SHIKOKU CHEMICALS CORPORATION (JP) 1980-02-19 — — US disclosed
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