SCHEMBL28449732

SCHEMBL28449732

C=CC(=O)N1CCCC(n2cc3ccc(-c4cccnc4)cc3n2)C1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.54

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
SCHEMBL28457746 0.93 BTK (0.54) BTK
SCHEMBL28456300 0.89 BTK (0.55) BTK
SCHEMBL29968858 0.86 BTK (0.58) BTK
SCHEMBL28455479 0.86 BTK (0.59) BTK
SCHEMBL29969258 0.86 BTK (0.59) BTK
SCHEMBL28457701 0.86 BTK (0.58) BTK
SCHEMBL28461595 0.86 BTK (0.55) BTK
SCHEMBL28459013 0.85 BTK (0.60) BTK
SCHEMBL28456041 0.85 BTK (0.59) BTK
SCHEMBL28458362 0.84 BTK (0.56) BTK

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-111662232-B Small molecule compound with 2H-indazole structure and synthesis and application thereof 中国科学院上海药物研究所 2022-08-02 CN disclosed
CN-111662232-A Small molecule compound with 2H-indazole structure and synthesis and application thereof 中国科学院上海药物研究所 2020-09-15 CN disclosed