SCHEMBL3558723

SCHEMBL3558723

CC(O)c1cccc(-c2cc3c(=O)n(CS(N)(=O)=O)c(=O)[nH]c3cc2C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 15/20 0.39
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
PTPN5 P54829 1/20 0.34
ELANE P08246 1/20 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
SCHEMBL4627698 0.84 DDR1 (0.36) DDR1
SCHEMBL2390375 0.83 PTPN5 (0.34) DDR1MAPK1PTPN5
SCHEMBL2390743 0.70 BRD4 (0.36) DDR1
Hydrochloric Acid SCHEMBL2390612 0.70 BRD4 (0.36) DDR1
SCHEMBL1692741 0.69 DDR1 (0.40) DDR1
SCHEMBL9942859 0.69 PDE3B (0.38) DDR1
SCHEMBL2389228 0.67 NMT1 (0.41) DDR1
SCHEMBL14719751 0.67 DDR1 (0.32) DDR1
SCHEMBL2391399 0.67 AKR1C3 (0.42)
SCHEMBL2388783 0.65 DDR1 (0.40) DDR1

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-7655666-B2 Substituted 1H-quinazoline-2,4-diones useful as AMPA receptor ligands NOVARTIS AG (CH) 2010-02-02 US disclosed
US-20080153836-A1 N-(2,4-Dioxo-1,4-dihydro-2H-quinazolin-3-yl)-methanesulfonamide derivatives; condensation, cyclization, reduction; AMPA (A-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid) receptor antagonists; schizophrenia, bipolar disorders, Parkinson's Disease, antiepileptic agents; psychological disorders NOVARTIS AG (CH) 2008-06-26 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 (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-20080153836-A1 N-(2,4-Dioxo-1,4-dihydro-2H-quinazolin-3-yl)-methanesulfonamide derivatives; condensation, cyclization, reduction; AMPA (A-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid) receptor antagonists; schizophrenia, bipolar disorders, Parkinson's Disease, antiepileptic agents; psychological disorders GRIN2A, GRIN1, GRIN2D DDR1 3161/4885KDM4E 2255/4885MAPK1 2873/4885

“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.