SCHEMBL19974724

SCHEMBL19974724

CCC(C(=O)C(=O)NCC1CC1)N(C=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 9/20 0.40
CYP2C19 P33261 1/20 0.36
SLC6A2 P23975 1/20 0.35
KDM1A O60341 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
MAOA P21397 1/20 0.35
EPHX1 P07099 1/20 0.35
ACHE P22303 2/20 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
SCHEMBL19975282 0.91 PTGIR (0.38) PTGIRCYP2C19SLC6A2KDM1ARCOR1
SCHEMBL21176277 0.85 PTGIR (0.41) PTGIRCYP2C19KDM1ARCOR1MAOA
SCHEMBL19975529 0.83 PTGIR (0.40) PTGIRCYP2C19KDM1ARCOR1MAOA
SCHEMBL19975576 0.83 ROCK2 (0.37) EPHX1
SCHEMBL19974884 0.82 ALDH1A1 (0.38) CYP2C19EPHX1
SCHEMBL19975136 0.81 EPHX1 (0.40) PTGIRSLC6A2EPHX1
SCHEMBL19975208 0.81 EPHX1 (0.43) SLC6A2EPHX1
SCHEMBL19975148 0.80 EPHX1 (0.45) EPHX1
SCHEMBL19975370 0.79 PTGIR (0.40) PTGIRCYP2C19SLC6A2
SCHEMBL19975274 0.76 PTGIR (0.41) PTGIRCYP2C19

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220356148-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2022-11-10 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
EP-3512836-A1 ANTIVIRAL COMPOUNDS Haplogen GmbH (AT) 2019-07-24 EP disclosed
WO-2018050631-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2018-03-22 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 (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-20190225575-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G12A, PLA2G4C PTGIR 540/4885CYP2C19 3198/4885SLC6A2 3243/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C PTGIR 679/4885CYP2C19 3143/4885SLC6A2 3542/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C PTGIR 540/4885CYP2C19 3198/4885SLC6A2 3243/4885

“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.