Sugi Predict

Sugi Predict / Compounds / SCHEMBL28494476

SCHEMBL28494476

SCHEMBL28494476

CC=CS(=O)(=O)Nc1cccc(-c2ccc(C(N)=O)c3[nH]c(C)c(C)c23)c1

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.81
▸ TEC P42680 2/20 0.55
▸ TXK P42681 2/20 0.55
▸ BMX P51813 2/20 0.55
▸ JAK3 P52333 2/20 0.55
▸ ITK Q08881 2/20 0.55
▸ ERBB4 Q15303 2/20 0.55
▸ JAK2 O60674 1/20 0.55

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
SCHEMBL29782378 0.89 BTK (1.00) BTKTECTXKBMXJAK3
SCHEMBL17699647 0.89 BTK (1.00) BTKTECTXKBMXJAK3
SCHEMBL17699759 0.86 BTK (0.80) BTKTECTXKBMXJAK3
SCHEMBL28494360 0.85 BTK (0.81) BTKJAK3
SCHEMBL28513619 0.84 BTK (0.59) BTKJAK3
SCHEMBL28501979 0.84 BTK (0.59) BTKTECTXKBMXJAK3
SCHEMBL29782478 0.84 BTK (0.59) BTKTECTXKBMXJAK3
SCHEMBL29782782 0.84 BTK (0.59) BTKJAK3
SCHEMBL28494330 0.82 BTK (0.80) BTKTECTXKBMXJAK3
SCHEMBL17699522 0.79 BTK (1.00) BTKTECTXKBMXJAK3

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-110511209-B Indole carboxamide compounds useful as kinase inhibitors 百时美施贵宝公司 2022-07-05 — — CN disclosed
CN-107108583-B Indole carboxamide compounds useful as kinase inhibitors 百时美施贵宝公司 2020-11-13 — — CN disclosed