SCHEMBL355374

SCHEMBL355374

O=C(NCc1ccc(Cl)s1)Nc1nc(CCl)ns1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.37
NPSR1 Q6W5P4 2/20 0.36
RAB9A P51151 4/20 0.35
NPC1 O15118 3/20 0.35
FFAR1 O14842 1/20 0.35
MMP3 P08254 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
KMT2A Q03164 4/20 0.34
KDM4E B2RXH2 4/20 0.34
MEN1 O00255 3/20 0.34
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 4/20 0.34
TSHR P16473 2/20 0.34
HSD17B10 Q99714 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
ROCK2 O75116 1/20 0.34
ROCK1 Q13464 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
SCHEMBL353436 0.88 ALDH1A1 (0.38) ALDH1A1NPSR1RAB9ANPC1FFAR1
SCHEMBL885408 0.87 NPC1 (0.40) ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2
SCHEMBL885407 0.86 ALDH1A1 (0.35) ALDH1A1NPSR1RAB9ANPC1FFAR1
SCHEMBL353277 0.78 KMT2A (0.36) ALDH1A1NPSR1RAB9ASMN1; SMN2KMT2A
SCHEMBL353276 0.78 KMT2A (0.36) ALDH1A1NPSR1RAB9ASMN1; SMN2KMT2A
SCHEMBL352427 0.77 SMN1; SMN2 (0.35) ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2
SCHEMBL4779015 0.77 MAPK1 (0.48) ALDH1A1NPSR1RAB9ASMN1; SMN2KMT2A
SCHEMBL354665 0.77 ALDH1A1 (0.34) ALDH1A1RAB9ASMN1; SMN2KMT2AHTT
SCHEMBL353960 0.76 HTT (0.36) ALDH1A1NPSR1RAB9ANPC1MMP3
SCHEMBL19119454 0.75 ALDH1A1 (0.33) ALDH1A1RAB9ASMN1; SMN2KMT2AHTT

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 11 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
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-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US 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
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 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
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 ALDH1A1 2806/4885NPSR1 2794/4885RAB9A 1714/4885

“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.