SCHEMBL276473

SCHEMBL276473

Cc1cc(C=O)ccc1Cl

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
VCAM1 P19320 1/20 0.50
ALDH1A3 P47895 5/20 0.47
HSD17B10 Q99714 2/20 0.46
CYP2A6 P11509 2/20 0.46
ALDH3A1 P30838 2/20 0.44
TSHR P16473 1/20 0.42
PTGS2 P35354 2/20 0.41
TYR P14679 1/20 0.41
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.40
PTGER4 P35408 1/20 0.39
TTR P02766 1/20 0.39
AOX1 Q06278 1/20 0.38
ALOX5 P09917 1/20 0.38
PTGS1 P23219 1/20 0.38

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
SCHEMBL29955168 1.00 ALDH1A1 (0.64) ALDH1A1VCAM1ALDH1A3HSD17B10CYP2A6
Ethane SCHEMBL2153562 0.98 ALDH1A1 (0.61) ALDH1A1VCAM1ALDH1A3HSD17B10CYP2A6
SCHEMBL8802168 0.84 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRTDP1TTR
SCHEMBL2153494 0.84 ALDH1A1 (0.47) ALDH1A1VCAM1ALDH1A3CYP2A6ALDH3A1
SCHEMBL29952189 0.82 ALDH1A1 (0.64) ALDH1A1VCAM1ALDH1A3HSD17B10CYP2A6
SCHEMBL980697 0.82 ALDH1A1 (0.64) ALDH1A1VCAM1ALDH1A3HSD17B10CYP2A6
SCHEMBL2154531 0.80 CYP1A2 (0.44) ALDH1A1VCAM1ALDH1A3ALDH3A1
SCHEMBL27875847 0.80 ALDH1A1 (0.40) ALDH1A1VCAM1ALDH1A3ALDH3A1PTGS2
SCHEMBL18346011 0.79 XDH (0.48) ALDH1A1VCAM1PTGS2KDM4ELMNA
SCHEMBL18346009 0.79 XDH (0.48) ALDH1A1VCAM1PTGS2KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117050112-A DOPO derivative containing benzazepine as well as preparation method and application thereof 西华大学 2023-11-14 CN claimed
US-RE48335-E1 Polymyxin derivatives as antimicrobial compounds MONASH UNIVERSITY (AU) 2020-12-01 US claimed
CN-106414480-B Polymyxin derivatives as antimicrobial compounds 莫纳什大学 2020-08-04 CN claimed
US-20170137469-A1 POLYMYXIN DERIVATIVES AS ANTIMICROBIAL COMPOUNDS MONASH UNIVERSITY (AU) 2017-05-18 US claimed
EP-3126376-A1 POLYMYXIN DERIVATIVES AS ANTIMICROBIAL COMPOUNDS Monash University (AU) 2017-02-08 EP claimed
WO-2015149131-A1 POLYMYXIN DERIVATIVES AS ANTIMICROBIAL COMPOUNDS MONASH UNIVERSITY (AU) 2015-10-08 WO claimed
CN-119707903-A Isopentenyl flavonoid compound and preparation method and application thereof 中山大学 2025-03-28 CN disclosed
CN-119569635-A Biaryl ring inhibitors targeting c-Myc proteins 上海深势唯思科技有限责任公司 2025-03-07 CN disclosed
CN-117362288-A Harmine derivative topoisomerase I inhibitor, preparation method and medical application thereof 中国药科大学 2024-01-09 CN disclosed
US-20230399322-A1 EIF4E INHIBITORS AND USES THEREOF PIC Therapeutics, Inc. 2023-12-14 US disclosed
CN-111344281-B Potassium channel inhibitors substituted benzimidazoles 阿塞西翁制药公司 2023-11-14 CN disclosed
CN-117050112-A DOPO derivative containing benzazepine as well as preparation method and application thereof 西华大学 2023-11-14 CN disclosed
US-11753403-B2 EIF4E inhibitors and uses thereof PIC Therapeutics, Inc. (US) 2023-09-12 US disclosed
EP-0168003-A1 Oxindol compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-01-15 EP disclosed
US-4514401-A CARDIOTONICS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-04-30 US disclosed
US-4487772-A CARDIOTONIC AGENTS OTSUKA PHARMACEUTICAL CO. LTD. (JP) 1984-12-11 US disclosed
EP-0126635-A2 Novel oxindole derivative OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-28 EP disclosed
US-4468402-A Carbostyril derivatives, process for producing the same and cardiotonic compositions containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-08-28 US disclosed
US-4454130-A CARDIOTONIC, HYPOTENSIVE AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-06-12 US disclosed
US-4415572-A CARDIOTONIC AND INOTROPIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1983-11-15 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 (3 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-20230399322-A1 EIF4E INHIBITORS AND USES THEREOF EIF4E, EIF4EBP1, EIF4A1 ALDH1A1 4776/4885VCAM1 4470/4885ALDH1A3 4660/4885
US-11753403-B2 EIF4E inhibitors and uses thereof EIF4E, EIF4EBP1, EIF4A1 ALDH1A1 4776/4885VCAM1 4470/4885ALDH1A3 4660/4885
US-20170137469-A1 POLYMYXIN DERIVATIVES AS ANTIMICROBIAL COMPOUNDS VIP, PEPD, NRDC ALDH1A1 4861/4885VCAM1 1436/4885ALDH1A3 4859/4885

“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.