SCHEMBL354749

SCHEMBL354749

Cc1cc(C(=O)N(C)Cc2csc(NC(=O)NCc3ccc(Cl)s3)n2)c2c(C)nn(C)c2n1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
S1PR2 O95136 3/20 0.36
LMNA P02545 4/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 2/20 0.33
PDE11A Q9HCR9 2/20 0.33
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 1/20 0.31
RAB9A P51151 3/20 0.31
NPC1 O15118 2/20 0.31
ROCK1 Q13464 1/20 0.31

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
SCHEMBL19119368 0.89 KDM4E (0.36) KDM4EALDH1A1HPGDHSD17B10S1PR2
SCHEMBL354091 0.85 MEN1 (0.35) KDM4EALDH1A1HPGDLMNAKMT2A
SCHEMBL353102 0.84 ROCK2 (0.46) LMNAMAPTROCK1
SCHEMBL352961 0.83 KMT2A (0.37) ALDH1A1LMNAKMT2AMEN1F2
SCHEMBL353525 0.83 RAB9A (0.38) KDM4EALDH1A1LMNAKMT2AMEN1
SCHEMBL355250 0.81 KMT2A (0.38) KDM4EALDH1A1HPGDLMNAKMT2A
SCHEMBL353762 0.79 NPC1 (0.37) ALDH1A1LMNAKMT2AMEN1F2
SCHEMBL19118750 0.79 KMT2A (0.37) KDM4EALDH1A1LMNAKMT2AMEN1
SCHEMBL353501 0.78 LMNA (0.39) KDM4ES1PR2LMNAKMT2AMEN1
SCHEMBL352881 0.77 KMT2A (0.40) KDM4EALDH1A1HSD17B10LMNAKMT2A

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 4 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
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 KDM4E 1862/4885ALDH1A1 2806/4885HPGD 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.