SCHEMBL19974839

SCHEMBL19974839

C/C=C/C(=O)NCCOC1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.35
EPHX2 P34913 3/20 0.34
NAAA Q02083 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 1/20 0.33
P2RX7 Q99572 1/20 0.33
APEX1 P27695 1/20 0.32
PKM P14618 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TGM2 P21980 1/20 0.32
GLA P06280 1/20 0.31
HPGD P15428 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
SCHEMBL19982712 0.81 EPHX1 (0.33) EPHX1SMN1; SMN2NPC1EPHX2NAAA
SCHEMBL22132035 0.78 EPHX1 (0.44) EPHX1SMN1; SMN2NPC1EPHX2NAAA
SCHEMBL14407371 0.73 EPHX1 (0.40) EPHX1SMN1; SMN2NPC1EPHX2NAAA
SCHEMBL22131907 0.73 MAPK1 (0.40) EPHX1SMN1; SMN2KDM4EALDH1A1
SCHEMBL29470599 0.72 HPGD (0.51) SMN1; SMN2KMT2AMEN1APEX1KDM4E
SCHEMBL19974764 0.71 EPHX1 (0.52) EPHX1NPC1EPHX2KMT2ARAB9A
SCHEMBL22187119 0.71 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AAPEX1ALDH1A1TGM2
SCHEMBL14642043 0.71 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AAPEX1ALDH1A1TGM2
SCHEMBL10803619 0.71 ZDHHC20 (0.46) EPHX1SMN1; SMN2NPC1EPHX2NAAA
SCHEMBL19974730 0.71 EPHX1 (0.38) EPHX1SMN1; SMN2NPC1EPHX2NAAA

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 EPHX1 372/4885SMN1; SMN2 706/4885NPC1 753/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C EPHX1 449/4885SMN1; SMN2 1086/4885NPC1 1213/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C EPHX1 372/4885SMN1; SMN2 706/4885NPC1 753/4885

“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.