SCHEMBL29709476

SCHEMBL29709476

NC(=O)c1ccc(-c2cccnc2)c2cc(-c3ccc(F)cc3)[nH]c12

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 15/20 0.80
CDC7 O00311 1/20 0.50
MKNK1 Q9BUB5 3/20 0.48
MKNK2 Q9HBH9 3/20 0.48
CHEK1 O14757 1/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL16336391 1.00 BTK (0.80) BTKCDC7MKNK1MKNK2CHEK1
SCHEMBL16336907 0.89 BTK (1.00) BTKCDC7MKNK1MKNK2CHEK1
SCHEMBL29709514 0.89 BTK (1.00) BTKCDC7CHEK1KCNH2
SCHEMBL16337806 0.89 BTK (1.00) BTKCDC7CHEK1KCNH2
SCHEMBL29709606 0.87 BTK (1.00) BTKCDC7
SCHEMBL16336553 0.87 BTK (1.00) BTKCDC7
SCHEMBL16337199 0.82 BTK (0.67) BTKMKNK1MKNK2
SCHEMBL16338291 0.81 BTK (1.00) BTKCDC7CHEK1KCNH2
SCHEMBL16336020 0.80 BTK (0.67) BTKCDC7MKNK1MKNK2
SCHEMBL16337712 0.79 BTK (0.65) BTKCDC7MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4008328-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2022-06-08 EP disclosed