SCHEMBL3718458

SCHEMBL3718458

Cc1cc(C)c(N(C)C(=O)c2cncs2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.35
KMT2A Q03164 3/20 0.35
GPBAR1 Q8TDU6 2/20 0.33
KIF11 P52732 1/20 0.33
ACLY P53396 1/20 0.33
DAO P14920 1/20 0.33
HSD17B1 P14061 3/20 0.32
HSD17B2 P37059 3/20 0.32
PIK3CD O00329 1/20 0.32
HSP90AA1 P07900 1/20 0.32
GRM5 P41594 1/20 0.31
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL2304794 0.76 KMT2A (0.41) KMT2AKIF11ACLYPIK3CDNPC1
Hydrochloric Acid SCHEMBL27646829 0.74 KMT2A (0.40) KMT2AKIF11ACLYPIK3CDNPC1
SCHEMBL23959147 0.73 KIF11 (0.41) KMT2AKIF11ACLYPIK3CDKDM4E
Hydrochloric Acid SCHEMBL29776090 0.72 KIF11 (0.40) KMT2AKIF11ACLYPIK3CDKDM4E
SCHEMBL1540045 0.72 LCK (0.50) KMT2ASMN1; SMN2
SCHEMBL6404488 0.71 LCK (0.33) KIF11GRM5
SCHEMBL30194928 0.71 HRH4 (0.38) KMT2AKIF11ACLYPIK3CD
SCHEMBL30237770 0.69 DPP4 (0.35) KMT2AKIF11ACLYPIK3CDNPC1
SCHEMBL23959384 0.68 KIF11 (0.50) KMT2AKIF11PIK3CDNPC1HPGD
Methyl Alcohol SCHEMBL28357518 0.68 KMT2A (0.43) KMT2ADAOPIK3CDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077875-A1 (5-(((2,4,6-Trimethylphenyl)amino)carbonyl)-4-methyl-2 -thiazolyl)carbamic Acid, 1,1-dimethylethyl ester for example; treating immunological and oncological disorders such as inflammatory bowel disease or cancer DAS JAGABANDHU (US) 2004-04-22 US claimed
WO-2010120388-A1 OLIGOMER-PROTEIN TYROSINE KINASE INHIBITOR CONJUGATES NEKTAR THERAPEUTICS (US) 2010-10-21 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-20040077875-A1 (5-(((2,4,6-Trimethylphenyl)amino)carbonyl)-4-methyl-2 -thiazolyl)carbamic Acid, 1,1-dimethylethyl ester for example; treating immunological and oncological disorders such as inflammatory bowel disease or cancer JAK1, LCK, MERTK S1PR4 1763/4885KMT2A 423/4885GPBAR1 621/4885

“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.