SCHEMBL19974719

SCHEMBL19974719

O=C(N[C@@H]1CCCC[C@@H]1O)C(=O)[C@H]1CCC(=O)N1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 6/20 0.46
CHRM1 P11229 6/20 0.45
GAA P10253 1/20 0.44
CAPN1 P07384 1/20 0.44
KMT2A Q03164 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ITGB1 P05556 1/20 0.41
ITGA4 P13612 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL19975341 1.00 P2RX7 (0.46) P2RX7CHRM1GAACAPN1KMT2A
SCHEMBL21183549 0.86 EPHX2 (0.50) P2RX7GAACAPN1KMT2AALDH1A1
SCHEMBL21176335 0.84 P2RX7 (0.48) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL21176218 0.84 P2RX7 (0.47) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL23758463 0.84 P2RX7 (0.47) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL19974981 0.84 P2RX7 (0.49) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL21183578 0.83 P2RX7 (0.51) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL21183582 0.83 P2RX7 (0.51) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL21183603 0.80 P2RX7 (0.52) P2RX7GAACAPN1KMT2AHDAC1
SCHEMBL19975222 0.80 P2RX7 (0.50) P2RX7GAACAPN1KMT2AHDAC1

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 P2RX7 339/4885CHRM1 1117/4885GAA 75/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C P2RX7 564/4885CHRM1 1777/4885GAA 107/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C P2RX7 339/4885CHRM1 1117/4885GAA 75/4885

“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.