SCHEMBL3708231

SCHEMBL3708231

NC(=O)c1ccc(-c2ccccc2F)c2c1[nH]c1cc(N3CCSC(=O)C3=O)ccc12

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.59
JAK2 O60674 2/20 0.59
AURKA O14965 1/20 0.59
LCK P06239 1/20 0.59
LYN P07948 1/20 0.59
KIT P10721 1/20 0.59
CDK2 P24941 1/20 0.59
TYK2 P29597 1/20 0.59
TEC P42680 1/20 0.59
TXK P42681 1/20 0.59
BMX P51813 1/20 0.59
ITK Q08881 1/20 0.59

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
SCHEMBL27982591 0.81 BTK (0.62) BTKJAK2AURKALCKLYN
SCHEMBL123407 0.81 BTK (0.74) BTKJAK2AURKALCKLYN
SCHEMBL123408 0.80 BTK (0.63) BTKJAK2AURKALCKLYN
SCHEMBL124441 0.80 BTK (0.67) BTKJAK2AURKALCKLYN
SCHEMBL122358 0.77 BTK (0.67) BTKJAK2AURKALCKLYN
SCHEMBL13284422 0.77 BTK (0.66) BTKJAK2AURKALCKLYN
SCHEMBL123665 0.76 BTK (0.64) BTKJAK2AURKALCKLYN
SCHEMBL148887 0.76 BTK (0.69) BTKJAK2AURKALCKLYN
SCHEMBL123345 0.76 BTK (0.80) BTKJAK2AURKALCKLYN
SCHEMBL123643 0.75 BTK (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2391602-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2011-12-07 EP disclosed
WO-2010080481-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-07-15 WO disclosed