SCHEMBL19409138

SCHEMBL19409138

C=CC(=O)N[C@H]1CCCC[C@H]1NC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
FGFR4 P22455 3/20 0.37
FGFR1 P11362 1/20 0.37
MAPK3 P27361 3/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.34
BTK Q06187 8/20 0.33

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
SCHEMBL19409147 0.96 FGFR4 (0.34) TAS1R3TAS1R1FGFR4FGFR1MAPK3
SCHEMBL9151004 0.92 TAS1R3 (0.42) TAS1R3TAS1R1FGFR4FGFR1MAPK3
SCHEMBL8362132 0.92 TAS1R3 (0.42) TAS1R3TAS1R1FGFR4FGFR1MAPK3
SCHEMBL9147601 0.92 TAS1R3 (0.42) TAS1R3TAS1R1FGFR4FGFR1MAPK3
SCHEMBL20959559 0.82 EPHX1 (0.42) TAS1R3TAS1R1HTTNPC1SMN1; SMN2
SCHEMBL8388655 0.82 EPHX1 (0.42) TAS1R3TAS1R1HTTNPC1SMN1; SMN2
SCHEMBL17371292 0.82 PSEN1 (0.41) TAS1R3TAS1R1FGFR4FGFR1MAPK3
SCHEMBL18972296 0.80 FGFR4 (0.39) TAS1R3TAS1R1FGFR4FGFR1MAPK3
SCHEMBL25293196 0.78 TAS1R3 (0.60) TAS1R3TAS1R1SMN1; SMN2
SCHEMBL15938041 0.78 MMP2 (0.53) TAS1R3TAS1R1FGFR4FGFR1MAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230097422-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHOD OF THEIR USE JANSSEN PHARMACEUTICA NV (BE) 2023-03-30 US disclosed
US-11319329-B2 Inhibitors of Bruton's tyrosine kinase and methods of their use JANSSEN PHARMACEUTICA NV (BE) 2022-05-03 US disclosed
US-20210101910-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHODS OF THEIR USE JANSSEN PHARMACEUTICA NV (BE) 2021-04-08 US disclosed
US-10934310-B2 Inhibitors of Bruton's tyrosine kinase and method of their use JANSSEN PHARMACEUTICA NV (BE) 2021-03-02 US disclosed
EP-3719022-A1 POLYCYCLIC COMPOUNDS AS INHIBITORS OF BRUTON'S TYROSINE KINASE Janssen Pharmaceutica NV (BE) 2020-10-07 EP disclosed
US-10717745-B2 Inhibitors of Bruton's tyrosine kinase and method of their use JANSSEN PHARMACEUTICA NV (BE) 2020-07-21 US disclosed
EP-3386991-B1 POLYCYCLIC COMPOUNDS AS INHIBITORS OF BRUTON'S TYROSINE KINASE JANSSEN PHARMACEUTICA NV (BE) 2020-06-03 EP disclosed
US-20190276471-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHOD OF THEIR USE JANSSEN PHARMACEUTICA NV (BE) 2019-09-12 US disclosed
US-20170283430-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHOD OF THEIR USE JANSSEN PHARMACEUTICA NV (BE) 2017-10-05 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-10934310-B2 Inhibitors of Bruton's tyrosine kinase and method of their use ABL1, BTK, LYN TAS1R3 4638/4885TAS1R1 4609/4885FGFR4 2584/4885
US-20170283430-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHOD OF THEIR USE ABL1, BTK, LYN TAS1R3 4638/4885TAS1R1 4609/4885FGFR4 2584/4885
US-20230097422-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHOD OF THEIR USE ABL1, BTK, LYN TAS1R3 4638/4885TAS1R1 4609/4885FGFR4 2584/4885
US-10717745-B2 Inhibitors of Bruton's tyrosine kinase and method of their use ABL1, BTK, LYN TAS1R3 4638/4885TAS1R1 4609/4885FGFR4 2584/4885
US-20210101910-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHODS OF THEIR USE ABL1, BTK, MYLK2 TAS1R3 4636/4885TAS1R1 4580/4885FGFR4 2635/4885
US-20190276471-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHOD OF THEIR USE ABL1, BTK, LYN TAS1R3 4638/4885TAS1R1 4609/4885FGFR4 2584/4885
US-11319329-B2 Inhibitors of Bruton's tyrosine kinase and methods of their use ABL1, BTK, MYLK2 TAS1R3 4636/4885TAS1R1 4580/4885FGFR4 2635/4885

“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.