SCHEMBL28484312

SCHEMBL28484312

COc1ccc(CN(Cc2ccc(OC)cc2)c2nccc3c2[nH]c(=O)n3CC2CCCN2C(=O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 5/20 0.42
▸ DYRK1A Q13627 1/20 0.37
▸ GRIN1 Q05586 3/20 0.36
▸ GRIN2B Q13224 3/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ BTK Q06187 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HRH1 P35367 2/20 0.35
▸ HRH4 Q9H3N8 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ FAP Q12884 1/20 0.35
▸ FFAR1 O14842 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ ADRA1B P35368 1/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ CCR1 P32246 1/20 0.34

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
SCHEMBL18818205 0.90 HRH3 (0.39) HRH3BTK
SCHEMBL18818206 0.90 HRH3 (0.39) HRH3BTK
SCHEMBL28484529 0.81 BTK (0.54) HRH3BTKFFAR1
SCHEMBL18285527 0.79 OPRM1 (0.40) KCNH2BTKALDH1A1HRH1HRH4
SCHEMBL29471042 0.76 OPRM1 (0.46) KCNH2ALDH1A1KDM4EUSP2HSD17B10
SCHEMBL28490621 0.74 HRH3 (0.40) HRH3GRIN2BALDH1A1SMN1; SMN2FAP
SCHEMBL18285610 0.73 BTK (0.54) HRH3BTK
SCHEMBL30111801 0.72 HTR6 (0.40) BTKALDH1A1HRH1HRH4OPRM1
SCHEMBL15711153 0.71 PRMT5 (0.40) HRH3KCNH2BTKALDH1A1
SCHEMBL28491911 0.71 HRH3 (0.38) HRH3GRIN2BALDH1A1FAPFFAR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113149983-B Tyrosine kinase inhibitors 普林斯匹亚生物制药公司 2024-03-29 — — CN disclosed
CN-113149983-A Tyrosine kinase inhibitors 普林斯匹亚生物制药公司 2021-07-23 — — CN disclosed
CN-106459049-B Tyrosine kinase inhibitors 普林斯匹亚生物制药公司 2020-11-27 — — CN disclosed
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