SCHEMBL2597419

SCHEMBL2597419

COC(=O)C1=C(NCC(=O)O)CCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 14/20 0.40
▸ SLC6A2 P23975 8/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ ACHE P22303 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35

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
SCHEMBL19264696 0.86 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL14752782 0.85 MAPT (0.40) TP53RAB9AKDM4EALDH1A1
SCHEMBL29013549 0.77 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL8648768 0.76 CA1 (0.52) SLC6A3SLC6A2SLC6A4KDM4EALDH1A1
SCHEMBL31384688 0.76 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL8636289 0.74 SLC6A3 (0.53) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL17373971 0.73 TP53 (0.37) TP53RAB9AKDM4EALDH1A1
SCHEMBL5656613 0.73 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4ACHEKDM4E
SCHEMBL11871305 0.72 TP53 (0.39) TP53RAB9A
SCHEMBL12777592 0.72 NLRP3 (0.41) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230302162-A1 RADIOLABELED DARAPLADIB AND ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2023-09-28 — — US disclosed
US-11583596-B2 Radiolabeled Darapladib and analogs thereof and their use as imaging compounds INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2023-02-21 — — US disclosed
EP-3687980-B1 RADIOLABELED DARAPLADIB, ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS INST NAT SANTE RECH MED (FR) 2022-01-19 — — EP disclosed
US-20200276337-A1 RADIOLABELED DARAPLADIB AND ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2020-09-03 — — US disclosed
WO-2019063634-A1 RADIOLABELED DARAPLADIB AND ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2019-04-04 — — WO disclosed
EP-2571857-B1 PROCESS FOR THE PREPARATION OF PYRIMIDINONE COMPOUNDS GLAXO GROUP LTD (GB) 2017-08-23 — — EP disclosed
EP-2571857-B1 PROCESS FOR THE PREPARATION OF PYRIMIDINONE COMPOUNDS GLAXO GROUP LTD (GB) 2017-08-23 — — EP disclosed
US-9725420-B2 Processes GLAXO GROUP LIMITED (GB) 2017-08-08 — — US disclosed
US-9725420-B2 Processes GLAXO GROUP LIMITED (GB) 2017-08-08 — — US disclosed
US-9725420-B2 Processes GLAXO GROUP LIMITED (GB) 2017-08-08 — — US disclosed
US-20160347720-A1 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2016-12-01 — — US disclosed
US-9447052-B2 Processes for preparing pyrimidine compounds GLAXO GROUP LIMITED (GB) 2016-09-20 — — US disclosed
US-9447052-B2 Processes for preparing pyrimidine compounds GLAXO GROUP LIMITED (GB) 2016-09-20 — — US disclosed
US-9447052-B2 Processes for preparing pyrimidine compounds GLAXO GROUP LIMITED (GB) 2016-09-20 — — US disclosed
EP-2571857-A1 NOVEL PROCESSES Glaxo Group Limited (GB) 2013-03-27 — — EP disclosed
US-20130060028-A1 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2013-03-07 — — US disclosed
US-20130060028-A1 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2013-03-07 — — US disclosed
US-20130060028-A1 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2013-03-07 — — US disclosed
WO-2011146494-A1 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2011-11-24 — — WO disclosed
WO-2011146494-A1 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2011-11-24 — — 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 (5 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-20130060028-A1 NOVEL PROCESSES CYP11B1, CYP27A1, CYP11B2 SLC6A3 4857/4885SLC6A2 4762/4885SLC6A4 4820/4885
US-11583596-B2 Radiolabeled Darapladib and analogs thereof and their use as imaging compounds PLA2G4B, PLA2G1B, PLA2G12B SLC6A3 3613/4885SLC6A2 3479/4885SLC6A4 4424/4885
US-20160347720-A1 NOVEL PROCESSES CYP11B1, CYP27A1, CYP11B2 SLC6A3 4857/4885SLC6A2 4762/4885SLC6A4 4820/4885
US-20230302162-A1 RADIOLABELED DARAPLADIB AND ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS PLA2G4B, PLA2G1B, PLA2G12B SLC6A3 3613/4885SLC6A2 3479/4885SLC6A4 4424/4885
US-20200276337-A1 RADIOLABELED DARAPLADIB AND ANALOGS THEREOF AND THEIR USE AS IMAGING COMPOUNDS PLA2G4B, PLA2G1B, PLA2G12B SLC6A3 3613/4885SLC6A2 3479/4885SLC6A4 4424/4885

“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.

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