SCHEMBL9871506

SCHEMBL9871506

COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.59
PDK2 Q15119 1/20 0.57
NPC1 O15118 2/20 0.55
LOX P28300 1/20 0.54
ACE P12821 1/20 0.54
ALDH1A1 P00352 1/20 0.53
RAB9A P51151 1/20 0.53
ALOX5 P09917 1/20 0.52

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
SCHEMBL1762519 1.00 KMT2A (0.59) KMT2APDK2NPC1LOXACE
SCHEMBL24435015 1.00 KMT2A (0.59) KMT2APDK2NPC1LOXACE
SCHEMBL3579235 0.96 NPC1 (0.57) KMT2APDK2NPC1LOXRAB9A
SCHEMBL3579233 0.96 NPC1 (0.57) KMT2APDK2NPC1LOXRAB9A
SCHEMBL13709423 0.92 PDK2 (0.56) KMT2APDK2NPC1LOXACE
SCHEMBL7068414 0.91 KMT2A (0.62) KMT2APDK2NPC1LOXACE
SCHEMBL2769546 0.91 KMT2A (0.62) KMT2APDK2NPC1LOXACE
SCHEMBL10721062 0.88 KMT2A (0.60) KMT2APDK2NPC1ALDH1A1RAB9A
SCHEMBL8633268 0.87 CNR1 (0.50) KMT2APDK2NPC1LOXACE
SCHEMBL6172949 0.86 NPC1 (0.53) KMT2APDK2NPC1LOXALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102216279-B Phenyl pyrimidone compounds, pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI Co.,Ltd. (CN) 2014-10-29 CN claimed
US-20250188032-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND USES THEREOF BNH RESEARCH CO., LTD. (KR) 2025-06-12 US disclosed
EP-4501910-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND USES THEREOF BNH Research Co., Ltd. (KR) 2025-02-05 EP disclosed
CN-119255981-A Nitrogen-containing heterocyclic compound and use thereof BNH研究有限责任公司 2025-01-03 CN disclosed
CN-111333627-B Substituted 2-hydro-pyrazole derivatives as anticancer agents 正大天晴药业集团股份有限公司 2024-09-13 CN disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
WO-2023191468-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND USES THEREOF 주식회사 비엔에이치리서치 2023-10-05 WO disclosed
WO-2023075435-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE 주식회사 베르티스 2023-05-04 WO disclosed
US-20220283131-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS CO., LTD. (KR) 2022-09-08 US disclosed
US-9969719-B2 Substituted 2-hydrogen-pyrazole derivative serving as anticancer drug CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2018-05-15 US disclosed
US-20180072707-A1 SUBSTITUTED 2-HYDROGEN-PYRAZOLE DERIVATIVE SERVING AS ANTICANCER DRUG CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2018-03-15 US disclosed
US-20180072707-A1 SUBSTITUTED 2-HYDROGEN-PYRAZOLE DERIVATIVE SERVING AS ANTICANCER DRUG CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2018-03-15 US disclosed
CN-107428731-A Substituted 2-hydro-pyrazole derivatives as anti-cancer agents 正大天晴药业集团股份有限公司 2017-12-01 CN disclosed
WO-2017134555-A1 DERIVATIVES OF PYRROLOIMIDAZOLE OR ANALOGUES THEREOF WHICH ARE USEFUL FOR THE TREATMENT OF INTER ALIA CANCER EMCURE PHARMACEUTICALS LIMITED (IN) 2017-08-10 WO disclosed
WO-2016141881-A1 SUBSTITUTED 2-HYDROGEN-PYRAZOLE DERIVATIVE SERVING AS ANTICANCER DRUG 南京明德新药研发股份有限公司 2016-09-15 WO disclosed
CN-102216279-B Phenyl pyrimidone compounds, pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI Co.,Ltd. (CN) 2014-10-29 CN disclosed
US-5051444-A Pyrrolidine derivatives as anti-amnesia agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-24 US disclosed
US-4880827-A Pyrrolidine derivatives having inhibitory action for proline specific endopepidase SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1989-11-14 US disclosed
EP-0238319-A1 Pyrrolidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-09-23 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-20180072707-A1 SUBSTITUTED 2-HYDROGEN-PYRAZOLE DERIVATIVE SERVING AS ANTICANCER DRUG CDK4, CDK6, CDK3 KMT2A 513/4885PDK2 53/4885NPC1 3516/4885
US-20250188032-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND USES THEREOF NLN, GRIN1, GRIN2A KMT2A 687/4885PDK2 940/4885NPC1 847/4885

“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.