SCHEMBL171948

SCHEMBL171948

CNC(=S)NC(=O)Cc1ccc(OC)c(OC)c1

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.78
GAA P10253 3/20 0.78
CTSD P07339 2/20 0.62
EPHX2 P34913 1/20 0.56
POLB P06746 1/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPT P10636 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 1/20 0.51
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALPL P05186 1/20 0.50
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL14817475 0.86 KMT2A (0.62) KMT2AGAACTSDEPHX2POLB
SCHEMBL17993526 0.85 KMT2A (0.64) KMT2AGAACTSDEPHX2POLB
SCHEMBL10203656 0.85 KMT2A (0.61) KMT2AGAACTSDEPHX2POLB
SCHEMBL2403269 0.85 KMT2A (0.71) KMT2AGAAEPHX2POLBKDM4E
SCHEMBL2605820 0.84 KMT2A (0.56) KMT2AGAAKDM4ETDP1MEN1
SCHEMBL169824 0.81 TDP1 (0.76) KMT2AGAAEPHX2KDM4ETDP1
SCHEMBL15892681 0.79 CTSD (0.61) KMT2AGAACTSDEPHX2POLB
SCHEMBL21156696 0.79 EPHX2 (0.64) KMT2AGAAEPHX2POLBKDM4E
SCHEMBL172027 0.78 HSD17B10 (0.58) KMT2AGAATDP1MEN1SMN1; SMN2
SCHEMBL171986 0.78 LMNA (0.53) KMT2AGAAPOLBKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9018378-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2015-04-28 US disclosed
US-8907091-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-8846927-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-09-30 US disclosed
US-8569503-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2013-10-29 US disclosed
US-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2013-06-27 US disclosed
US-20120095234-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS Mirati Therapeutics, Inc. 2012-04-19 US disclosed
EP-2426108-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MethylGene Inc. (CA) 2012-03-07 EP 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 (2 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-20120095234-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS MAP3K19, MAP3K9, MAP4K2 KMT2A 938/4885GAA 2409/4885CTSD 2264/4885
US-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET KMT2A 2353/4885GAA 764/4885CTSD 1482/4885

“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.