SCHEMBL27982129

SCHEMBL27982129

NC(=O)c1ccc(-c2ccccc2F)c2c1[nH]c1cc(CN3CCCCC3)ccc12

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.60
JAK2 O60674 8/20 0.60
AURKA O14965 1/20 0.60
LCK P06239 1/20 0.60
LYN P07948 1/20 0.60
KIT P10721 1/20 0.60
CDK2 P24941 1/20 0.60
TYK2 P29597 1/20 0.60
TEC P42680 1/20 0.60
TXK P42681 1/20 0.60
BMX P51813 1/20 0.60
ITK Q08881 1/20 0.60

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
SCHEMBL27982558 0.91 BTK (0.71) BTKJAK2AURKALCKLYN
SCHEMBL123643 0.91 BTK (0.59) BTKJAK2AURKALCKLYN
SCHEMBL122351 0.84 BTK (0.63) BTKJAK2AURKALCKLYN
SCHEMBL123651 0.80 BTK (0.70) BTKJAK2AURKALCKLYN
SCHEMBL27857331 0.80 BTK (0.59) BTKJAK2AURKALCKLYN
SCHEMBL124441 0.79 BTK (0.67) BTKJAK2AURKALCKLYN
SCHEMBL122358 0.79 BTK (0.67) BTKJAK2AURKALCKLYN
SCHEMBL27982068 0.79 BTK (0.59) BTKJAK2AURKALCKLYN
SCHEMBL13284422 0.78 BTK (0.66) BTKJAK2AURKALCKLYN
SCHEMBL153930 0.78 BTK (0.56) BTKJAK2AURKALCKLYN

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
CN-102325753-B Carbazole carboxamide compounds useful as kinase inhibitors BRISTOL MYERS SQUIBB CO 2014-09-10 CN claimed