SCHEMBL31349388

SCHEMBL31349388

Cn1c(-c2ccccc2)nc2c(Br)ccc(Br)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 6/20 0.46
▸ ADORA2A P29274 5/20 0.46
▸ ADORA3 P0DMS8 4/20 0.45
▸ ADORA1 P30542 3/20 0.45
▸ PI4KA P42356 1/20 0.45
▸ PI4K2B Q8TCG2 1/20 0.45
▸ PI4K2A Q9BTU6 1/20 0.45
▸ PI4KB Q9UBF8 1/20 0.45
▸ TLR7 Q9NYK1 1/20 0.44
▸ CASR P41180 1/20 0.44
▸ DHODH Q02127 1/20 0.42
▸ IKBKB O14920 1/20 0.42
▸ CHUK O15111 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ PLK1 P53350 1/20 0.42
▸ BTK Q06187 1/20 0.42
▸ ITK Q08881 1/20 0.42
▸ IKBKE Q14164 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ HPGD P15428 1/20 0.40

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
SCHEMBL19988571 0.78 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBCASR
SCHEMBL822576 0.74 HPGD (0.55) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL25360338 0.73 TLR7 (0.46) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL30494769 0.73 TLR7 (0.46) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL5486079 0.69 TLR7 (0.51) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL762312 0.69 KDM4E (0.50) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL10739020 0.69 TLR7 (0.55) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL30494909 0.68 ADORA2B (0.43) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL25359782 0.68 ADORA2B (0.43) ADORA2BADORA2AADORA3ADORA1PI4KA
SCHEMBL10738089 0.68 TLR7 (0.54) ADORA2BADORA2AADORA3ADORA1PI4KA

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
CN-119409949-A Electrochromic polymer with yellow-transparent display, and preparation method and application thereof 浙江工业大学 2025-02-11 — — CN claimed
CN-119409949-A Electrochromic polymer with yellow-transparent display, and preparation method and application thereof 浙江工业大学 2025-02-11 — — CN disclosed
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