SCHEMBL17119645

SCHEMBL17119645

O=c1c(-c2c(F)cccc2F)cc2cnc(Cl)cc2n1C1CCOC1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BTK Q06187 12/20 0.70
LYN P07948 6/20 0.70
SRC P12931 8/20 0.49
BRAF P15056 2/20 0.42
KRAS P01116 1/20 0.42
RAF1 P04049 1/20 0.42
KDR P35968 1/20 0.42
MAP2K2 P36507 1/20 0.42
MAP2K1 Q02750 1/20 0.42
FGFR1 P11362 1/20 0.40
FGFR4 P22455 1/20 0.40
SCN9A Q15858 2/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37

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
SCHEMBL17119632 0.86 BTK (0.68) BTKLYNSRCFGFR1FGFR4
SCHEMBL17119703 0.86 BTK (0.66) BTKLYNSRCFGFR1FGFR4
SCHEMBL17119635 0.83 BTK (0.69) BTKLYNSRCFGFR1
SCHEMBL17099299 0.82 BTK (1.00) BTKLYNSRC
SCHEMBL16964571 0.82 BTK (1.00) BTKLYNSRC
SCHEMBL17099092 0.82 BTK (1.00) BTKLYNSRC
SCHEMBL17119651 0.81 BTK (0.70) BTKLYNSRCFGFR1
SCHEMBL21240597 0.80 FGFR4 (0.58) BTKLYNSRCFGFR1FGFR4
SCHEMBL17099040 0.77 BTK (0.84) BTKLYNSRCFGFR1
SCHEMBL17099091 0.77 BTK (0.84) BTKLYNSRCFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9714247-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2017-07-25 US disclosed
US-9714247-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2017-07-25 US disclosed
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-04-20 US disclosed
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-04-20 US disclosed
US-9493454-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2016-11-15 US disclosed
US-9493454-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2016-11-15 US disclosed
US-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MANNKIND CORPORATION 2015-09-24 US disclosed
US-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MANNKIND CORPORATION 2015-09-24 US 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 (2 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-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 BTK 245/4885LYN 330/4885SRC 161/4885
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 BTK 245/4885LYN 330/4885SRC 161/4885

“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.