SCHEMBL172027

SCHEMBL172027

CNC(=S)NC(=O)Cc1cc(OC)ccc1OC

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.58
▸ KMT2A Q03164 5/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ SIGMAR1 Q99720 1/20 0.49
▸ GLS O94925 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ MTNR1A P48039 1/20 0.47
▸ MTNR1B P49286 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ ADRA1A P35348 1/20 0.47
▸ TAAR1 Q96RJ0 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MAPK8 P45983 1/20 0.46
▸ MAPK9 P45984 1/20 0.46

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
SCHEMBL14019865 0.86 HSD17B10 (0.55) HSD17B10KMT2AMEN1SIGMAR1GLS
SCHEMBL171970 0.86 KMT2A (0.59) HSD17B10KMT2AMEN1GLSALDH1A1
SCHEMBL17993524 0.85 HSD17B10 (0.60) HSD17B10KMT2AMEN1SIGMAR1GLS
SCHEMBL13619977 0.82 ATM (0.59) KMT2AMEN1GLSGAATAAR1
SCHEMBL13485784 0.80 HSD17B10 (0.69) HSD17B10KMT2AMEN1SIGMAR1GLS
SCHEMBL2826592 0.79 HSD17B10 (0.67) HSD17B10KMT2AMEN1SIGMAR1GLS
SCHEMBL6500250 0.79 HSD17B10 (0.67) HSD17B10KMT2AMEN1SIGMAR1GLS
SCHEMBL169824 0.79 TDP1 (0.76) KMT2AMEN1GAATDP1NPSR1
SCHEMBL171948 0.78 KMT2A (0.78) KMT2AMEN1GAATDP1ALDH1A1
SCHEMBL30104106 0.76 HSD17B10 (0.73) HSD17B10KMT2AMEN1GLSMTNR1A

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 10 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-8404846-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-03-26 — — 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
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 — — US disclosed
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2009-10-22 — — 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 (4 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 HSD17B10 2594/4885KMT2A 938/4885MEN1 1071/4885
US-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET HSD17B10 3782/4885KMT2A 2353/4885MEN1 3231/4885
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 HSD17B10 2594/4885KMT2A 938/4885MEN1 1071/4885
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET HSD17B10 3782/4885KMT2A 2353/4885MEN1 3231/4885

“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.

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