SCHEMBL25880968

SCHEMBL25880968

NC(=O)NCc1ccnc(OC(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.42
PTGES O14684 3/20 0.42
GRM2 Q14416 6/20 0.41
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39
LOX P28300 3/20 0.39
LOXL2 Q9Y4K0 3/20 0.39
KLKB1 P03952 1/20 0.38
NR3C2 P08235 2/20 0.36

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
SCHEMBL25229935 0.87 PTGES (0.43) PTGESGRM2CYP2C9CYP2C19HCRTR1
SCHEMBL25880555 0.86 KLKB1 (0.46) RECQLCYP2C9CYP2C19LOXLOXL2
SCHEMBL25880834 0.85 RECQL (0.41) RECQLPTGESCYP2C9CYP2C19LOX
SCHEMBL25616855 0.84 PTGES (0.43) PTGESGRM2HCRTR1HCRTR2KLKB1
SCHEMBL31174780 0.83 RECQL (0.40) RECQLCYP2C9CYP2C19LOXLOXL2
SCHEMBL25639248 0.83 RECQL (0.40) RECQLCYP2C9CYP2C19LOXLOXL2
SCHEMBL25880976 0.82 RECQL (0.39) RECQLCYP2C9CYP2C19LOXLOXL2
SCHEMBL25880602 0.81 LOX (0.57) RECQLCYP2C9CYP2C19LOXLOXL2
SCHEMBL8226463 0.81 L3MBTL1 (0.44) RECQLPTGESGRM2
SCHEMBL25880800 0.81 RECQL (0.42) RECQLCYP2C9CYP2C19LOXLOXL2

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 3 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
CN-118525003-A Novel heteroaryl urea compounds as KV7.2 inhibitors 伊卡根有限责任公司 2024-08-20 CN disclosed
WO-2023121992-A1 CYCLOPROPYL COMPOUNDS ICAGEN, LLC (US) 2023-06-29 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 RECQL 476/4885PTGES 3936/4885GRM2 4196/4885

“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.