SCHEMBL21447294

SCHEMBL21447294

CCC(COC)Oc1nc(C)nc(Nc2ccc(F)cc2F)c1C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.38
MKNK2 Q9HBH9 7/20 0.37
FGFR1 P11362 1/20 0.36
FLT1 P17948 1/20 0.36
KDR P35968 1/20 0.36
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DYRK1A Q13627 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
THRB P10828 1/20 0.35
MAPK1 P28482 1/20 0.34
PKM P14618 1/20 0.33
POLB P06746 1/20 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
SCHEMBL21447140 0.92 MKNK2 (0.37) CRHR1MKNK2
SCHEMBL21447122 0.88 MKNK2 (0.35) CRHR1MKNK2KDR
SCHEMBL21447295 0.86 CRHR1 (0.36) CRHR1
SCHEMBL21447176 0.81 CRHR1 (0.37) CRHR1
SCHEMBL19952874 0.81 CRHR1 (0.48) CRHR1GAA
SCHEMBL21447121 0.81 CRHR1 (0.36) CRHR1
SCHEMBL21447164 0.77 CRHR1 (0.45) CRHR1
SCHEMBL21447293 0.77 CRHR1 (0.37) CRHR1
SCHEMBL21447162 0.75 MAPK1 (0.35) CRHR1MAPK1
SCHEMBL21447167 0.75 CRHR1 (0.38) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11077108-B2 Allosteric corticotropin-releasing factor receptor 1 (CRFR1) antagonists that decrease p-tau and improve cognition THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-08-03 US disclosed
US-20190307747-A1 ALLOSTERIC CORTICOTROPIN-RELEASING FACTOR RECEPTOR 1 (CRFR1) ANTAGONISTS THAT DECREASE P-TAU AND IMPROVE COGNITION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-10-10 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-11077108-B2 Allosteric corticotropin-releasing factor receptor 1 (CRFR1) antagonists that decrease p-tau and improve cognition CRHR1, CRH, CRHR2 CRHR1 1/4885MKNK2 2832/4885FGFR1 401/4885
US-20190307747-A1 ALLOSTERIC CORTICOTROPIN-RELEASING FACTOR RECEPTOR 1 (CRFR1) ANTAGONISTS THAT DECREASE P-TAU AND IMPROVE COGNITION CRHR1, CRH, CRHR2 CRHR1 1/4885MKNK2 1330/4885FGFR1 780/4885

“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.