SCHEMBL17034341

SCHEMBL17034341

COC(=O)c1nc(SC)ncc1C=O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
NTRK1 P04629 1/20 0.37
SYK P43405 1/20 0.36

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
SCHEMBL13716857 0.86 KMT2A (0.45) KMT2AMEN1L3MBTL1NPSR1ALDH1A1
SCHEMBL6169765 0.81 KMT2A (0.49) KMT2AMEN1L3MBTL1NPSR1ALDH1A1
SCHEMBL29439591 0.79 KMT2A (0.47) KMT2AMEN1L3MBTL1NPSR1ALDH1A1
SCHEMBL628538 0.79 KMT2A (0.47) KMT2AMEN1L3MBTL1NPSR1ALDH1A1
SCHEMBL4225491 0.79 KMT2A (0.69) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL13716846 0.79 KMT2A (0.47) KMT2AMEN1L3MBTL1NPSR1ALDH1A1
SCHEMBL21617345 0.79 KMT2A (0.47) KMT2AMEN1L3MBTL1NPSR1ALDH1A1
SCHEMBL15507979 0.79 ALDH1A1 (0.42) KMT2AMEN1L3MBTL1ALDH1A1MAPT
SCHEMBL17024284 0.79 ALDH1A1 (0.42) KMT2AMEN1L3MBTL1ALDH1A1MAPT
SCHEMBL31507703 0.79 ALDH1A1 (0.42) KMT2AMEN1L3MBTL1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402912-A1 INHIBITOR COMPOUNDS INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2022-12-22 US disclosed
US-11046688-B2 Inhibitor compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-06-29 US disclosed
US-20200165241-A1 INHIBITOR COMPOUNDS INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2020-05-28 US disclosed
US-10479788-B2 Compounds that inhibit MPS1 kinase CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-11-19 US disclosed
EP-3293183-B1 INHIBITOR COMPOUNDS CANCER RESEARCH TECH LTD (GB) 2019-07-24 EP disclosed
US-20180141944-A1 INHIBITOR COMPOUNDS INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2018-05-24 US disclosed
EP-3293183-A1 INHIBITOR COMPOUNDS Cancer Research Technology Ltd. (GB) 2018-03-14 EP disclosed
US-9890157-B2 Inhibitor compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-02-13 US disclosed
US-9834552-B2 Inhibitor compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-12-05 US disclosed
EP-2892889-B1 INHIBITOR COMPOUNDS CANCER RES TECH LTD (GB) 2017-10-18 EP disclosed
US-9409907-B2 Inhibitor compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2016-08-09 US disclosed
US-20160220570-A1 INHIBITOR COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2016-08-04 US disclosed
US-20160222009-A1 INHIBITOR COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2016-08-04 US disclosed
US-20150239884-A1 INHIBITOR COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-08-27 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 (8 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-10479788-B2 Compounds that inhibit MPS1 kinase BUB1B, BUB1, CDK1 KMT2A 2725/4885MEN1 601/4885L3MBTL1 2470/4885
US-20220402912-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885
US-20150239884-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885
US-11046688-B2 Inhibitor compounds BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885
US-20180141944-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885
US-20160222009-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885
US-20200165241-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885
US-20160220570-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885MEN1 457/4885L3MBTL1 2606/4885

“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.