SCHEMBL368549

SCHEMBL368549

CCOC(=O)C(=O)c1csc(NC(=O)NCc2ccc(Cl)c(Cl)c2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.48
ROCK1 Q13464 9/20 0.44
ROCK2 O75116 8/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
PABPC1 P11940 1/20 0.44
S100A4 P26447 1/20 0.44
KMT2A Q03164 1/20 0.44
EIF4H Q15056 1/20 0.44
MAPK1 P28482 2/20 0.43
LMNA P02545 1/20 0.43
TRPV1 Q8NER1 2/20 0.43
EGFR P00533 1/20 0.42
AURKA O14965 1/20 0.42
DYRK3 O43781 1/20 0.42
PRKD3 O94806 1/20 0.42
PRKCG P05129 1/20 0.42
PRKACA P17612 1/20 0.42

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
SCHEMBL354643 0.90 L3MBTL1 (0.59) TSHRSMN1; SMN2L3MBTL1MEN1MAPT
Urea SCHEMBL4725120 0.87 L3MBTL1 (0.56) TSHRSMN1; SMN2L3MBTL1ROCK1ROCK2
SCHEMBL10466214 0.85 L3MBTL1 (0.60) SMN1; SMN2L3MBTL1MEN1MAPTKMT2A
SCHEMBL10466253 0.84 ROCK2 (0.55) SMN1; SMN2L3MBTL1ROCK1ROCK2MEN1
SCHEMBL353536 0.84 ROCK1 (0.49) TSHRROCK1ROCK2MEN1MAPT
SCHEMBL353310 0.83 ROCK1 (0.59) SMN1; SMN2L3MBTL1ROCK1ROCK2MAPT
SCHEMBL354603 0.83 ROCK1 (0.50) TSHRSMN1; SMN2L3MBTL1ROCK1ROCK2
SCHEMBL4780435 0.82 LMNA (0.64) SMN1; SMN2MEN1MAPTKMT2AMAPK1
SCHEMBL353659 0.80 TSHR (0.47) TSHRSMN1; SMN2ROCK1ROCK2MEN1
Urea SCHEMBL4776814 0.80 LMNA (0.60) SMN1; SMN2MEN1MAPTKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2200440-B1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS CRESTONE INC (US) 2017-07-19 EP disclosed
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 US disclosed
EP-2200440-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS Crestone, Inc. (US) 2010-06-30 EP disclosed
WO-2009015208-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA TSHR 2748/4885SMN1; SMN2 2356/4885L3MBTL1 4619/4885

“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.