SCHEMBL17119643

SCHEMBL17119643

O=c1c(-c2ccccc2)cc2cnc(Cl)cc2n1-c1ccncc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 12/20 0.52
LYN P07948 8/20 0.43
SRC P12931 8/20 0.43
MEN1 O00255 1/20 0.41
HSP90AA1 P07900 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.38
FGFR1 P11362 1/20 0.38
EGLN1 Q9GZT9 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
SCHEMBL17119663 0.92 BTK (0.48) BTKLYNSRCEGLN1
SCHEMBL17119649 0.88 BTK (0.53) BTKLYNSRCMAPTEGLN1
SCHEMBL17119622 0.78 SRC (0.53) BTKLYNSRCFGFR1
SCHEMBL4426075 0.78 BTK (0.46) BTKLYNSRCMEN1KMT2A
SCHEMBL17119638 0.77 BTK (0.67) BTKLYNSRCFGFR1
SCHEMBL16963446 0.76 BTK (0.63) BTKLYNSRC
SCHEMBL17119627 0.75 LYN (0.51) BTKLYNSRC
SCHEMBL501865 0.74 PLA2G7 (0.41) BTKLYNSRCALDH1A1FGFR1
SCHEMBL17119666 0.72 BTK (0.51) BTKLYNSRCALDH1A1
SCHEMBL16963459 0.71 BTK (0.58) BTKLYNSRC

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.