SCHEMBL19982846

SCHEMBL19982846

CCC(NCC1CN(C(=O)OC(C)(C)C)C1)C(O)C(=O)NCC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.43
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
ACKR3 P25106 1/20 0.38
EPHX1 P07099 1/20 0.37
CTSK P43235 2/20 0.37
CTSS P25774 1/20 0.37
NR1H2 P55055 1/20 0.37
POLB P06746 1/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GLS O94925 1/20 0.35
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
METAP1 P53582 1/20 0.34
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34

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
SCHEMBL21176301 0.92 KDM4E (0.48) KDM4EPKMEPHX1CTSKCTSS
SCHEMBL19974859 0.85 TSHR (0.38) KDM4EEPHX1CTSKPOLBKMT2A
SCHEMBL19982734 0.80 KDM4E (0.45) KDM4EPKMEPHX1CTSKCTSS
SCHEMBL21176275 0.79 NAMPT (0.38) NAMPTKDM4EPKMACKR3EPHX1
SCHEMBL21176375 0.79 KDM4E (0.50) KDM4EPKMEPHX1POLBKMT2A
SCHEMBL19975303 0.78 MEN1 (0.37) KDM4EEPHX1CTSKPOLBKMT2A
SCHEMBL19652084 0.74 NAMPT (0.56) NAMPTKDM4EPKMACKR3EPHX1
SCHEMBL24392671 0.74 NAMPT (0.52) NAMPTKDM4EPKMACKR3EPHX1
SCHEMBL21183506 0.73 EPHX1 (0.46) KDM4EEPHX1KMT2ASMN1; SMN2TSHR
SCHEMBL21176171 0.73 KDM4E (0.44) KDM4EPKMEPHX1POLBKMT2A

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 6 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
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 NAMPT 1229/4885KDM4E 3330/4885PKM 2897/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C NAMPT 1286/4885KDM4E 3784/4885PKM 3299/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C NAMPT 1229/4885KDM4E 3330/4885PKM 2897/4885

“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.