SCHEMBL754722

SCHEMBL754722

COCCn1ccnc1C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.58
ALDH1A1 P00352 2/20 0.58
POLB P06746 1/20 0.58
TSHR P16473 1/20 0.49
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
MEN1 O00255 2/20 0.45
FDPS P14324 1/20 0.45
KDM4E B2RXH2 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL23657179 0.89 ALDH1A1 (0.65) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL8678546 0.86 KMT2A (0.60) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL4779659 0.83 ALDH1A1 (0.72) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL5438077 0.81 ALDH1A1 (0.59) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL19794294 0.79 ALDH1A1 (0.62) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL739728 0.79 KMT2A (0.53) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL24540417 0.79
SCHEMBL25009512 0.79 ALDH1A1 (0.80) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL27090339 0.79 ALDH1A1 (0.80) KMT2AALDH1A1POLBTSHRCA12
SCHEMBL2062301 0.78 KMT2A (0.40) KMT2AALDH1A1POLBMEN1LMNA

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 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11897877-B2 Inhibitor compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-02-13 US disclosed
WO-2023230609-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2023-11-30 WO disclosed
US-20220402912-A1 INHIBITOR COMPOUNDS INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2022-12-22 US disclosed
US-20220402912-A1 INHIBITOR COMPOUNDS INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2022-12-22 US disclosed
WO-2022164997-A1 METHODS FOR THE TREATMENT OF FIBROTIC DISEASE SHY THERAPEUTICS, LLC (US) 2022-08-04 WO disclosed
US-11046688-B2 Inhibitor compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-06-29 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-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
WO-2012129322-A1 IMPROVED SYNTHESIS OF TETRABUTYLAMMONIUM BIS(FLUOROSULFONYL)IMIDE AND RELATED SALTS TRINAPCO, INC. (US) 2012-09-27 WO disclosed
EP-2500368-A2 Catalyst and process for producing a rigid polyurethane foam Tosoh Corporation (JP) 2012-09-19 EP disclosed
US-8138181-B2 Imidazo[1,2-a]pyridine compounds as receptor tyrosine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2012-03-20 US disclosed
US-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2011-07-07 US disclosed
US-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2011-07-07 US disclosed
US-20100029633-A1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS RECEPTOR TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-02-04 US disclosed
WO-2009149508-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2009-12-17 WO disclosed
US-20070043132-A1 Catalyst and process for producing a rigid polyurethane foam TOSOH CORPORATION (JP) 2007-02-22 US disclosed
US-20040082465-A1 Catalyst and process for producing a rigid polyurethane foam TOSOH CORPORATION (JP) 2004-04-29 US disclosed
EP-1382624-A1 Catalyst and process for producing a rigid polyurethane foam Tosoh Corporation (JP) 2004-01-21 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 (7 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-20100029633-A1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS RECEPTOR TYROSINE KINASE INHIBITORS PIM1, PIM3, PIM2 KMT2A 543/4885ALDH1A1 717/4885POLB 3600/4885
US-10479788-B2 Compounds that inhibit MPS1 kinase BUB1B, BUB1, CDK1 KMT2A 2725/4885ALDH1A1 4006/4885POLB 1349/4885
US-20220402912-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885ALDH1A1 3742/4885POLB 1230/4885
US-11046688-B2 Inhibitor compounds BUB1B, BUB1, CDK1 KMT2A 2793/4885ALDH1A1 3742/4885POLB 1230/4885
US-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF KCNA3, KCNB1, KCNK3 KMT2A 845/4885ALDH1A1 4002/4885POLB 4507/4885
US-11897877-B2 Inhibitor compounds BUB1B, BUB1, CDK1 KMT2A 2793/4885ALDH1A1 3742/4885POLB 1230/4885
US-20200165241-A1 INHIBITOR COMPOUNDS BUB1B, BUB1, CDK1 KMT2A 2793/4885ALDH1A1 3742/4885POLB 1230/4885

“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.