SCHEMBL25211129

SCHEMBL25211129

Cc1ccnc(OC(F)F)n1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.45
GRIN1 Q05586 10/20 0.45
GRIN2B Q13224 10/20 0.45
EDNRB P24530 1/20 0.44
EDNRA P25101 1/20 0.44
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
ROCK1 Q13464 1/20 0.34
ALOX5AP P20292 3/20 0.34
FEN1 P39748 3/20 0.34

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
SCHEMBL31174746 1.00 RXRA (0.45) RXRAGRIN1GRIN2BEDNRBEDNRA
SCHEMBL12593659 0.82 EDNRB (0.46) RXRAGRIN1GRIN2BEDNRBEDNRA
SCHEMBL29370636 0.82 EDNRB (0.46) RXRAGRIN1GRIN2BEDNRBEDNRA
SCHEMBL25596642 0.78 EDNRB (0.47) RXRAGRIN1GRIN2BEDNRBEDNRA
SCHEMBL23978003 0.78 EDNRB (0.44) RXRAGRIN1GRIN2BEDNRBEDNRA
SCHEMBL21910852 0.77 RXRA (0.42) RXRAGRIN1GRIN2BEDNRBEDNRA
SCHEMBL9194413 0.76 RXRA (0.45) RXRAGRIN1GRIN2BROCK1
SCHEMBL1153496 0.74
SCHEMBL30125106 0.74
SCHEMBL7049033 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250074901-A1 NOVEL HETEROARYL COMPOUNDS ANGELINI PHARMA S.P.A. (IT) 2025-03-06 US disclosed
EP-4433453-A1 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS Icagen, LLC (US) 2024-09-25 EP disclosed
WO-2023091554-A9 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS ICAGEN, LLC (US) 2024-05-23 WO disclosed
WO-2023091554-A1 NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS ICAGEN, LLC (US) 2023-05-25 WO 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 (1 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-20250074901-A1 NOVEL HETEROARYL COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP3A43, F12 RXRA 2475/4885GRIN1 2299/4885GRIN2B 2202/4885

“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.