SCHEMBL354377

SCHEMBL354377

Cc1cc(C(=O)N(C)Cc2nsc(NC(=O)NCc3ccc(Cl)s3)n2)c2c(n1)c(C)nn2C

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RAB9A P51151 4/20 0.32
NPC1 O15118 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
BRD4 O60885 2/20 0.31
HTT P42858 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
SCHEMBL19119086 0.90 SHMT2 (0.31) ALDH1A1KDM4EHPGDHSD17B10RAB9A
SCHEMBL352427 0.84 SMN1; SMN2 (0.35) ALDH1A1KDM4EHPGDRAB9ANPC1
SCHEMBL354138 0.83 ROCK2 (0.43) NPC1KMT2AMEN1
SCHEMBL354345 0.81 KMT2A (0.32) ALDH1A1KDM4ERAB9ASMN1; SMN2KMT2A
SCHEMBL19119282 0.80 RAB9A (0.33) ALDH1A1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL353121 0.80 ATG4B (0.36) ALDH1A1HPGDRAB9ANPC1SMN1; SMN2
SCHEMBL353752 0.79 LMNA (0.39) ALDH1A1KDM4ERAB9ASMN1; SMN2KMT2A
SCHEMBL352627 0.78 ALDH1A1 (0.32) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL353858 0.77 HTT (0.42) ALDH1A1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL353272 0.77 KMT2A (0.37) ALDH1A1KDM4EHSD17B10KMT2AMEN1

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
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-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

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 2806/4885KDM4E 1862/4885HPGD 1814/4885

“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.