SCHEMBL19974918

SCHEMBL19974918

O=C(O)C(=O)C1CCC(=O)N1CC1CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.35
P2RX7 Q99572 11/20 0.34
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
KMT2A Q03164 2/20 0.33
GAA P10253 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NOTUM Q6P988 1/20 0.31

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
SCHEMBL19975087 0.93 PTGER4 (0.35) ACEP2RX7KMT2AMEN1MAPT
SCHEMBL19974787 0.89 FEN1 (0.37) ACEP2RX7KMT2AALDH1A1
SCHEMBL19975095 0.86 ACE (0.43) ACEP2RX7TP53MDM2KMT2A
SCHEMBL19975273 0.79 ACE (0.41) ACEP2RX7KMT2AMEN1MAPT
SCHEMBL21183569 0.77 SMN1; SMN2 (0.40) KMT2AGAAMAPTALDH1A1
SCHEMBL21176199 0.76 EPHX1 (0.36) P2RX7MDM2KMT2AMAPTHTT
SCHEMBL21176369 0.76 EPHX1 (0.36) P2RX7MDM2KMT2AMAPTHTT
SCHEMBL19975108 0.76 FEN1 (0.41) ACEP2RX7KMT2AMEN1ALDH1A1
SCHEMBL21176253 0.75 EPHX1 (0.39) MDM2KMT2AMAPTHTTALDH1A1
SCHEMBL19974905 0.74 P2RX7 (0.54) P2RX7KMT2AGAAMEN1MAPT

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 7 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-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
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 ACE 94/4885P2RX7 339/4885TP53 3256/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C ACE 145/4885P2RX7 564/4885TP53 3198/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C ACE 94/4885P2RX7 339/4885TP53 3256/4885

“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.