SCHEMBL353858

SCHEMBL353858

CN(Cc1nsc(NC(=O)NCc2ccc(Cl)s2)n1)C(=O)c1nn(C)c(=O)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.42
ALDH1A1 P00352 7/20 0.40
POLB P06746 2/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 2/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 4/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
GAA P10253 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RECQL P46063 1/20 0.35
RAB9A P51151 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
SCHEMBL19119501 0.88 HTT (0.35) HTTALDH1A1POLBPKMMAPK1
SCHEMBL354183 0.87 HTT (0.44) HTTALDH1A1POLBPKMMAPK1
SCHEMBL352889 0.85 KMT2A (0.43) HTTALDH1A1POLBMAPK1LMNA
SCHEMBL351886 0.84 SMN1; SMN2 (0.44) HTTALDH1A1POLBPKMMAPK1
SCHEMBL352427 0.81 SMN1; SMN2 (0.35) HTTALDH1A1POLBLMNANPSR1
SCHEMBL354448 0.78 KMT2A (0.33) HTTALDH1A1POLBLMNASMN1; SMN2
SCHEMBL352627 0.78 ALDH1A1 (0.32) HTTALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL353752 0.77 LMNA (0.39) HTTALDH1A1POLBLMNASMN1; SMN2
SCHEMBL354377 0.77 ALDH1A1 (0.32) HTTALDH1A1LMNANPSR1SMN1; SMN2
Phthalazinone SCHEMBL19118752 0.77 ALDH1A1 (0.35) HTTALDH1A1LMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US claimed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 US claimed
EP-2200440-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS Crestone, Inc. (US) 2010-06-30 EP claimed
WO-2009015208-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 WO claimed
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 HTT 1843/4885ALDH1A1 2806/4885POLB 1884/4885

“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.