SCHEMBL24550793

SCHEMBL24550793

CCc1c(Nc2cnc(C(F)(F)F)cc2C(=O)O)ccc(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 7/20 0.41
▸ SYK P43405 3/20 0.39
▸ SCN10A Q9Y5Y9 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ASPH Q12797 1/20 0.37
▸ RIOX2 Q8IUF8 1/20 0.37
▸ KDM8 Q8N371 1/20 0.37
▸ AKR1C3 P42330 1/20 0.36
▸ AKR1C2 P52895 1/20 0.36
▸ MAP2K2 P36507 1/20 0.36
▸ MAP2K1 Q02750 1/20 0.36
▸ METAP2 P50579 1/20 0.35
▸ LIPC P11150 1/20 0.35
▸ LIPG Q9Y5X9 1/20 0.35
▸ WDR5 P61964 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL30824177 1.00 DHODH (0.41) DHODHSYKSCN10AKDM4EASPH
SCHEMBL24550099 0.87 KCNQ3 (0.39) SYKSCN10AKDM4EMAP2K2MAP2K1
SCHEMBL30824157 0.87 KCNQ3 (0.39) SYKSCN10AKDM4EMAP2K2MAP2K1
SCHEMBL24550624 0.86 DHODH (0.47) DHODHAKR1C3AKR1C2MAP2K2MAP2K1
Hydrochloric Acid SCHEMBL29073606 0.85 DHODH (0.46) DHODHAKR1C3AKR1C2MAP2K2MAP2K1
Hydrochloric Acid SCHEMBL29722181 0.85 DHODH (0.46) DHODHAKR1C3AKR1C2MAP2K2MAP2K1
SCHEMBL26931044 0.82 ACVR1B (0.39) DHODHSYK
SCHEMBL27170880 0.82 MPO (0.43) DHODHKDM4EASPHRIOX2KDM8
SCHEMBL24552895 0.80 DHODH (0.37) DHODHSCN10AKDM4E
SCHEMBL30824154 0.80 DHODH (0.37) DHODHSCN10AKDM4E

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-20240083896-A1 Nitrogen Containing 2,3-Dihydroquinazolinone Compounds as Nav1.8 Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-03-14 — — US disclosed
WO-2022129281-A1 NITROGEN CONTAINING 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-06-23 — — 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-20240083896-A1 Nitrogen Containing 2,3-Dihydroquinazolinone Compounds as Nav1.8 Inhibitors SCN8A, SCN1A, SCN2A DHODH 828/4885SYK 3288/4885SCN10A 8/4885

“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.

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