SCHEMBL19975437

SCHEMBL19975437

CC(C(=O)C(=O)NCC1CCCCC1)N(C)C(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
EPHX1 P07099 2/20 0.46
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.44
OPRK1 P41145 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
BCHE P06276 3/20 0.42
NPC1 O15118 1/20 0.42
EPHX2 P34913 1/20 0.42
NPY5R Q15761 1/20 0.42

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
SCHEMBL19975178 0.94 PTGIR (0.43) SMN1; SMN2ALDH1A1
SCHEMBL21176225 0.78 SMN1; SMN2 (0.43) SMN1; SMN2EPHX1ALDH1A1GAAL3MBTL1
SCHEMBL19975149 0.78 SMN1; SMN2 (0.55) SMN1; SMN2EPHX1ALDH1A1LMNAOPRK1
SCHEMBL19975148 0.78 EPHX1 (0.45) SMN1; SMN2EPHX1ALDH1A1GAAL3MBTL1
SCHEMBL19975008 0.77 EPHX1 (0.44) SMN1; SMN2EPHX1ALDH1A1GAAL3MBTL1
SCHEMBL19975418 0.77 SMN1; SMN2 (0.42) SMN1; SMN2EPHX1ALDH1A1GAAL3MBTL1
SCHEMBL19975210 0.77 SMN1; SMN2 (0.53) SMN1; SMN2EPHX1ALDH1A1LMNAOPRK1
SCHEMBL21176286 0.77 S1PR3 (0.49) SMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL19975208 0.76 EPHX1 (0.43) SMN1; SMN2EPHX1ALDH1A1GAAL3MBTL1
SCHEMBL19974762 0.76 SMN1; SMN2 (0.41) SMN1; SMN2EPHX1ALDH1A1GAAL3MBTL1

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 SMN1; SMN2 706/4885EPHX1 372/4885ALDH1A1 2271/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C SMN1; SMN2 1086/4885EPHX1 449/4885ALDH1A1 2673/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C SMN1; SMN2 706/4885EPHX1 372/4885ALDH1A1 2271/4885

“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.