SCHEMBL18599138

SCHEMBL18599138

Cc1nn(SF)c2ncnc(N)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 4/20 0.39
▸ SRC P12931 7/20 0.38
▸ ABL1 P00519 5/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ HTT P42858 3/20 0.38
▸ KDR P35968 3/20 0.38
▸ MTOR P42345 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ RET P07949 2/20 0.38
▸ PLK4 O00444 1/20 0.38
▸ RIPK2 O43353 1/20 0.38
▸ ROCK2 O75116 1/20 0.38
▸ PRKD3 O94806 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ ERBB2 P04626 1/20 0.38
▸ INSR P06213 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ CSF1R P07333 1/20 0.38

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
SCHEMBL10260251 0.74 PIK3CD (0.52) EGFRSRCABL1KDRMTOR
SCHEMBL23057484 0.74 EGFR (0.42) EGFRSRCABL1KDM4EHTT
SCHEMBL23057505 0.73 EGFR (0.41) EGFRSRCABL1KDM4EHTT
SCHEMBL24458341 0.71 ADK (0.44) EGFRSRCABL1KDM4EHTT
SCHEMBL13019650 0.70 SRC (0.64) EGFRSRCABL1KDM4EHTT
SCHEMBL10261918 0.70 SRC (0.66) EGFRSRCABL1KDRMTOR
SCHEMBL10261498 0.70 PIK3CD (0.53) EGFRSRCABL1KDM4EHTT
SCHEMBL24096479 0.68 SRC (0.61) EGFRSRCABL1KDRMTOR
SCHEMBL10261070 0.67 SRC (0.52) EGFRSRCABL1KDM4EKDR
SCHEMBL21028946 0.66 PIK3CD (0.55) EGFRSRCABL1KDM4EHTT

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-3138842-A1 POLYFLUORINATED COMPOUNDS ACTING AS BRUTON'S TYROSINE KINASE INHIBITORS Zhejiang DTRM Biopharma Co., Ltd. (CN) 2017-03-08 — — EP disclosed
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