SCHEMBL16655794

SCHEMBL16655794

C=CC(=O)N1CC(n2nc(-c3cnc(OC)c(F)c3)c3c(N)ncnc32)Cc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.59
PIK3CD O00329 5/20 0.51
FGFR2 P21802 4/20 0.51
EGFR P00533 3/20 0.51
ITK Q08881 5/20 0.50
FGFR1 P11362 1/20 0.49
FGFR4 P22455 1/20 0.49
FGFR3 P22607 1/20 0.49

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
SCHEMBL16665823 0.92 BTK (0.54) BTKFGFR2EGFRITKFGFR1
SCHEMBL16655511 0.92 BTK (0.54) BTKFGFR2EGFRITKFGFR1
SCHEMBL16655589 0.87 BTK (0.57) BTKPIK3CDFGFR2EGFRITK
SCHEMBL16655810 0.85 BTK (0.71) BTKPIK3CDFGFR2EGFR
SCHEMBL16665820 0.85 ITK (0.66) BTKPIK3CDFGFR2EGFRITK
SCHEMBL16655703 0.85 ITK (0.66) BTKPIK3CDFGFR2EGFRITK
SCHEMBL16665689 0.84 PIK3CD (0.70) BTKPIK3CDEGFR
SCHEMBL16655762 0.84 PIK3CD (0.70) BTKPIK3CDEGFR
SCHEMBL23917523 0.84 BTK (0.47) BTKFGFR2FGFR1FGFR4FGFR3
SCHEMBL16656013 0.84 PIK3CD (0.69) BTKPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 US claimed
EP-3057970-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Medivation Technologies, Inc. (US) 2016-08-24 EP claimed
WO-2015058084-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-23 WO claimed
WO-2015058084-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210317140-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB BTK 1/4885PIK3CD 2/4885FGFR2 1759/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.