SCHEMBL21176360

SCHEMBL21176360

CC(C)(C)C(=O)N1CCC(NC(=O)C(=O)[C@H]2CCC(=O)N2Cc2ccccc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
CAPN1 P07384 2/20 0.44
SIGMAR1 Q99720 5/20 0.44
P2RX7 Q99572 3/20 0.43
GAA P10253 1/20 0.43
ITGB1 P05556 1/20 0.42
ITGA4 P13612 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DPP7 Q9UHL4 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
SCHEMBL21176233 0.89 GPR119 (0.50) KMT2AMEN1POLBL3MBTL1
SCHEMBL21183582 0.87 P2RX7 (0.51) KMT2AMEN1CAPN1SIGMAR1P2RX7
SCHEMBL21183578 0.87 P2RX7 (0.51) KMT2AMEN1CAPN1SIGMAR1P2RX7
SCHEMBL21176345 0.87 CAPN1 (0.45) KMT2AMEN1CAPN1SIGMAR1P2RX7
SCHEMBL19974895 0.86 DPP7 (0.54) KMT2AMEN1SIGMAR1P2RX7ITGB1
SCHEMBL21176161 0.86 DPP7 (0.54) KMT2AMEN1CAPN1SIGMAR1P2RX7
SCHEMBL21183549 0.85 EPHX2 (0.50) KMT2AMEN1CAPN1P2RX7GAA
SCHEMBL19974981 0.85 P2RX7 (0.49) KMT2ACAPN1SIGMAR1P2RX7GAA
SCHEMBL21176322 0.82 GPR119 (0.44) KMT2ACAPN1P2RX7GAAL3MBTL1
SCHEMBL21183583 0.82 P2RX7 (0.47) KMT2ACAPN1SIGMAR1P2RX7GAA

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-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

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 KMT2A 4031/4885MEN1 4331/4885CAPN1 1497/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C KMT2A 4177/4885MEN1 4361/4885CAPN1 1555/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C KMT2A 4031/4885MEN1 4331/4885CAPN1 1497/4885

“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.