SCHEMBL9502514

SCHEMBL9502514

CCc1cccc2oc(=O)c(N)c(CC)c12

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.49
GAA P10253 10/20 0.44
KDM4E B2RXH2 7/20 0.44
MAPT P10636 3/20 0.44
HSD17B10 Q99714 3/20 0.44
ALDH1A1 P00352 4/20 0.43
NQO1 P15559 1/20 0.40
POLB P06746 1/20 0.38
HTT P42858 1/20 0.37
HPGD P15428 2/20 0.36
ALOX15 P16050 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
SCHEMBL28351931 0.89 ELANE (0.46) ELANEGAAKDM4EMAPTHSD17B10
SCHEMBL1401009 0.82 ELANE (0.44) ELANEGAAKDM4EMAPTHSD17B10
SCHEMBL11230576 0.82 ELANE (0.44) ELANEGAAKDM4EMAPTHSD17B10
SCHEMBL27715978 0.82 SMN1; SMN2 (0.41) ELANEKDM4EMAPTALDH1A1POLB
SCHEMBL21645801 0.78 GAA (0.62) GAAKDM4EMAPTHSD17B10ALDH1A1
SCHEMBL4867725 0.78 ELANE (0.47) ELANEKDM4EMAPTHSD17B10ALDH1A1
SCHEMBL4274245 0.75 KDM4E (0.39) GAAKDM4EMAPTHSD17B10ALDH1A1
SCHEMBL11230582 0.72 KDM4E (0.37) ELANEGAAKDM4EMAPTHSD17B10
SCHEMBL5613862 0.72 NQO1 (0.40) ELANEALDH1A1NQO1
SCHEMBL15068613 0.71 ELANE (0.39) ELANEGAAKDM4EMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210299285-A1 COMPOUNDS USEFUL FOR IN VIVO IMAGING OF PROTEIN OXIDATION AND/OR CANCER TREATMENT UNIV WAKE FOREST HEALTH SCIENCES (US) 2021-09-30 US claimed
WO-2020018613-A1 COMPOUNDS USEFUL FOR IN VIVO IMAGING OF PROTEIN OXIDATION AND/OR CANCER TREATMENT WAKE FOREST UNIVERSITY HEALTH SCIENCES (US) 2020-01-23 WO claimed
CN-107206109-A For in vitro and in vivo detection bacterium and/or the fluorescence multi-branched probe of fungi 爱丁堡大学董事会 2017-09-26 CN claimed
CN-107106707-A The molecular probe of gramnegative bacterium is detected in vitro and in vivo 爱丁堡大学董事会 2017-08-29 CN claimed
CN-107109399-A Visualizing modified nucleotide and nucleic acid interactions in a single cell 西格马-奥尔德里奇有限责任公司 2017-08-29 CN claimed
US-4312855-A FOR IMPROVING DEPOSITION OR RETENTION OF ACTIVE MATERIAL; HAIR CONDITIONERS, DETERGENTS COLGATE-PALMOLIVE COMPANY (US) 1982-01-26 US claimed
US-20210299285-A1 COMPOUNDS USEFUL FOR IN VIVO IMAGING OF PROTEIN OXIDATION AND/OR CANCER TREATMENT UNIV WAKE FOREST HEALTH SCIENCES (US) 2021-09-30 US disclosed
WO-2020018613-A1 COMPOUNDS USEFUL FOR IN VIVO IMAGING OF PROTEIN OXIDATION AND/OR CANCER TREATMENT WAKE FOREST UNIVERSITY HEALTH SCIENCES (US) 2020-01-23 WO disclosed
CN-103995437-B Negative-type photosensitive silicone composition AZ电子材料(卢森堡)有限公司 2019-11-29 CN disclosed
CN-110337497-A Pass through multi-wad join labeled oligonucleotide probe 德国癌症研究公共权益基金会 2019-10-15 CN disclosed
CN-110325212-A The farnesyl transferase inhibitor of method for treating cancer 库拉肿瘤学公司 2019-10-11 CN disclosed
CN-110325912-A Photosensitive resin composition, method for producing cured pattern, cured product, interlayer insulating film, cover coat, surface protective film, and electronic component 日立化成杜邦微系统股份有限公司 2019-10-11 CN disclosed
CN-110234600-A Molecule nano label 美国政府(由卫生和人类服务部的部长所代表) 2019-09-13 CN disclosed
CN-1154708-C Chemical-ray sensitive polymer composition 东丽株式会社 2004-06-23 CN disclosed
CN-1480491-A Light sensitivity resin precursor compsn. ������������ʽ���� 2004-03-10 CN disclosed
CN-1405325-A RNA probe preparation method, Target nucleic acid detection method and RNA probe preparation kit RIKAGAKU KENKYUSHO (JP) 2003-03-26 CN disclosed
CN-1222187-A Mid-chain branched surfactants PROCTER & GAMBLE (US) 1999-07-07 CN disclosed
CN-1201061-A Chemical-ray sensitive polymer composition TORAY CO LTD (JP) 1998-12-09 CN disclosed
EP-0543990-A1 PHOTOLITHOGRAPHICALLY PATTERNED FLUORESCENT COATING EASTMAN KODAK COMPANY (US) 1993-06-02 EP disclosed
WO-1992022855-A1 PHOTOLITHOGRAPHICALLY PATTERNED FLUORESCENT COATING EASTMAN KODAK COMPANY (US) 1992-12-23 WO 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 (1 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-20210299285-A1 COMPOUNDS USEFUL FOR IN VIVO IMAGING OF PROTEIN OXIDATION AND/OR CANCER TREATMENT QSOX1, GPX4, SDHA ELANE 1391/4885GAA 2437/4885KDM4E 3379/4885

“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.