SCHEMBL4675972

SCHEMBL4675972

CSc1nnc(C(=O)O)c(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.36
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
PPARG P37231 2/20 0.33
HCAR2 Q8TDS4 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPK1 P28482 1/20 0.32
MAPT P10636 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIK1 P39086 1/20 0.30
GRIA1 P42261 1/20 0.30
GRIA2 P42262 1/20 0.30
GRIA3 P42263 1/20 0.30
GRIA4 P48058 1/20 0.30

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
SCHEMBL16786091 0.85 MEN1 (0.39) MEN1KMT2ANPSR1SMN1; SMN2PPARG
SCHEMBL4683449 0.78 KMT2A (0.43) MEN1KMT2ANPSR1PPARGALDH1A1
Hydrochloric Acid SCHEMBL11318178 0.77 KMT2A (0.42) MEN1KMT2ANPSR1PPARGALDH1A1
SCHEMBL28835178 0.77 KMT2A (0.54) MEN1KMT2ATDP1SMN1; SMN2PPARG
SCHEMBL4681332 0.77 MEN1 (0.42) MEN1KMT2ATDP1NPSR1PPARG
SCHEMBL29478350 0.77 MEN1 (0.42) MEN1KMT2ATDP1NPSR1PPARG
SCHEMBL5925649 0.76 MEN1 (0.42) MEN1KMT2ANPSR1ALDH1A1MAPK1
SCHEMBL29558416 0.76 MEN1 (0.42) MEN1KMT2ANPSR1ALDH1A1MAPK1
SCHEMBL15206568 0.76 MAPT (0.41) MEN1KMT2ATDP1NPSR1SMN1; SMN2
SCHEMBL282501 0.74 SMN1; SMN2 (0.47) MEN1KMT2ASMN1; SMN2PPARGALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3760625-A1 BICYCLIC LACTAMS AS RECEPTOR-INTERACTING PROTEIN-1 (RIP1) KINASE INHIBITORS FOR TREATING E.G. INFLAMMATORY DISEASES F. Hoffmann-La Roche AG (CH) 2021-01-06 EP disclosed
EP-3495358-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES Bristol-Myers Squibb Company (US) 2019-06-12 EP disclosed
WO-2017004500-A9 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed
WO-2017004500-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-05 WO disclosed
EP-1195378-B1 Pyridotriazines and pyridopyridazines WARNER LAMBERT CO (US) 2008-01-23 EP disclosed
EP-1575956-B1 FUNGICIDES BASED ON NITROGEN-CONTAINING HETEROCYCLES SYNGENTA LTD (GB) 2007-03-28 EP disclosed
US-6683183-B2 BICYCLIC HETEROCYCLES THAT INHIBIT CYCLIN-DEPENDENT KINASE OR TYROSINE KINASE ENZYMES, OR BOTH, FOR TREATMENT OF PROLIFERATIVE DISORDERS WARNER-LAMBERT COMPANY 2004-01-27 US disclosed
US-20020061865-A1 Pyridotriazines and pyridopyridazines KRAMER JAMES BERNARD (US) 2002-05-23 US disclosed
EP-1195378-A1 Pyridotriazines and pyridopyridazines WARNER-LAMBERT COMPANY (US) 2002-04-10 EP 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-20020061865-A1 Pyridotriazines and pyridopyridazines CDK1, CDK4, CDK2 MEN1 3098/4885KMT2A 1661/4885TDP1 878/4885

“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.