SCHEMBL30660469

SCHEMBL30660469

COC(=O)c1cc(OCC(F)(F)F)ccc1Br

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
ALDH1A1 P00352 5/20 0.56
POLB P06746 2/20 0.48
RAB9A P51151 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 3/20 0.45
NPSR1 Q6W5P4 2/20 0.44
NOTUM Q6P988 1/20 0.44
SOS1 Q07889 1/20 0.44
MAPT P10636 2/20 0.44

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
SCHEMBL1098123 0.84 CYP2C9 (0.73) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL8232877 0.83 CYP2C9 (0.54) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL28255789 0.83 CYP1A2 (0.60) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL20594585 0.82 ALDH1A1 (0.47) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL4649362 0.82 KDM4E (0.50) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL8227206 0.82 CYP2C9 (0.55) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL3909475 0.81 CA12 (0.57) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL20429979 0.81 KMT2A (0.45) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL28255772 0.81 CYP2C9 (0.54) KDM4ECYP1A2CYP2C9ALDH1A1POLB
SCHEMBL22749456 0.80 CFTR (0.62) KDM4ECYP1A2CYP2C9ALDH1A1POLB

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-20250368647-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2025-12-04 US disclosed
EP-4536660-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2025-04-16 EP disclosed
WO-2023238065-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-12-14 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-20250368647-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS SCN8A, SCN2A, SCN5A KDM4E 2636/4885CYP1A2 1602/4885CYP2C9 830/4885

“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.