SCHEMBL21176161

SCHEMBL21176161

O=C(NC1CCN(C(=O)NC2CCC2)CC1)C(=O)[C@H]1CCC(=O)N1Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.54
KDM4E B2RXH2 1/20 0.48
SIGMAR1 Q99720 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
P2RX7 Q99572 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
USP30 Q70CQ3 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ITGB1 P05556 1/20 0.42
ITGA4 P13612 1/20 0.42
CCR3 P51677 1/20 0.42
CAPN1 P07384 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GAA P10253 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
SCHEMBL19974895 0.98 DPP7 (0.54) DPP7KDM4ESIGMAR1SMN1; SMN2P2RX7
SCHEMBL19974981 0.92 P2RX7 (0.49) SIGMAR1SMN1; SMN2P2RX7KMT2AITGB1
SCHEMBL21183549 0.89 EPHX2 (0.50) SMN1; SMN2P2RX7MEN1KMT2ACAPN1
SCHEMBL21183582 0.87 P2RX7 (0.51) SIGMAR1P2RX7MEN1KMT2AITGB1
SCHEMBL21183578 0.87 P2RX7 (0.51) SIGMAR1P2RX7MEN1KMT2AITGB1
SCHEMBL21176360 0.86 KMT2A (0.45) DPP7SIGMAR1P2RX7MEN1KMT2A
SCHEMBL21176345 0.85 CAPN1 (0.45) SIGMAR1P2RX7MEN1KMT2AITGB1
SCHEMBL21176233 0.83 GPR119 (0.50) KDM4ENPSR1USP30MEN1KMT2A
SCHEMBL21176390 0.82 SIGMAR1 (0.42) DPP7SIGMAR1SMN1; SMN2P2RX7ITGB1
SCHEMBL21183550 0.82 CAPN1 (0.47) SIGMAR1SMN1; SMN2P2RX7KMT2AITGB1

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 DPP7 586/4885KDM4E 3330/4885SIGMAR1 1966/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C DPP7 514/4885KDM4E 3784/4885SIGMAR1 2229/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C DPP7 586/4885KDM4E 3330/4885SIGMAR1 1966/4885

“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.