SCHEMBL17677995

SCHEMBL17677995

Nc1ncccc1-c1cc2ccccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 3/20 0.57
KDR P35968 3/20 0.57
APP P05067 2/20 0.50
CYP19A1 P11511 1/20 0.48
FYN P06241 1/20 0.47
FGFR1 P11362 1/20 0.44
PIK3CD O00329 1/20 0.44
PIK3CA P42336 1/20 0.44
PIK3CB P42338 1/20 0.44
PIK3CG P48736 1/20 0.44
PRKDC P78527 1/20 0.44
CKS1B P61024 1/20 0.44
SKP2 Q13309 1/20 0.44
MAPKAPK2 P49137 1/20 0.43
MAP4K4 O95819 1/20 0.42
TBK1 Q9UHD2 1/20 0.42
IKBKB O14920 1/20 0.42
TNK2 Q07912 1/20 0.41
PLAU P00749 1/20 0.41
CDK2 P24941 2/20 0.41

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
SCHEMBL15260648 0.82 CYP19A1 (0.49) PDGFRBKDRAPPCYP19A1FGFR1
SCHEMBL29177680 0.81 CYP19A1 (0.48) PDGFRBKDRAPPCYP19A1FGFR1
SCHEMBL29986368 0.81 CYP19A1 (0.48) PDGFRBKDRAPPCYP19A1FGFR1
SCHEMBL27644143 0.81 CYP19A1 (0.48) PDGFRBKDRAPPCYP19A1FYN
SCHEMBL10213421 0.79 MAPKAPK2 (0.64) PDGFRBKDRAPPFYNMAPKAPK2
SCHEMBL1971330 0.79 CYP19A1 (0.47) PDGFRBKDRAPPCYP19A1FYN
SCHEMBL19133572 0.78 APP (0.57) APPCYP19A1PIK3CACA1CA2
SCHEMBL17287941 0.78 CYP19A1 (0.46) PDGFRBKDRAPPCYP19A1FYN
SCHEMBL17668132 0.78 PDGFRB (0.67) PDGFRBKDRMKNK1MKNK2
SCHEMBL398852 0.78 APP (0.58) APPFYNPIK3CDPIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210115029-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2021-04-22 US disclosed
US-10669265-B2 Pyridyl benzothiophenes as kinase inhibitors ALLERGAN, INC. (US) 2020-06-02 US disclosed
US-10633373-B2 Pyridyl benzothiophenes as kinase inhibitors ALLERGAN, INC. (US) 2020-04-28 US disclosed
US-20180111921-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2018-04-26 US disclosed
US-20180111921-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2018-04-26 US disclosed
US-20180105515-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2018-04-19 US disclosed
US-20180105515-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2018-04-19 US disclosed
US-9868726-B2 Pyridyl benzothiophenes as kinase inhibitors ALLERGAN, INC. (US) 2018-01-16 US disclosed
US-9868726-B2 Pyridyl benzothiophenes as kinase inhibitors ALLERGAN, INC. (US) 2018-01-16 US disclosed
US-20170107210-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2017-04-20 US disclosed
US-20170107210-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN INC (US) 2017-04-20 US disclosed
US-9371314-B2 Pyridyl benzothiophenes as kinase inhibitors ALLERGAN, INC. (US) 2016-06-21 US disclosed
US-9371314-B2 Pyridyl benzothiophenes as kinase inhibitors ALLERGAN, INC. (US) 2016-06-21 US disclosed
US-20160102080-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN, INC. 2016-04-14 US disclosed
US-20160102080-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS ALLERGAN, INC. 2016-04-14 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 (7 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-20160102080-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885
US-20180105515-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885
US-10633373-B2 Pyridyl benzothiophenes as kinase inhibitors PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885
US-20180111921-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885
US-20170107210-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885
US-20210115029-A1 PYRIDYL BENZOTHIOPHENES AS KINASE INHIBITORS PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885
US-10669265-B2 Pyridyl benzothiophenes as kinase inhibitors PDXK, MAP4K5, MAP4K2 PDGFRB 127/4885KDR 226/4885APP 1526/4885

“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.