SCHEMBL19974740

SCHEMBL19974740

CCOC(=O)C(CC1CCC1)NCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.46
USP2 O75604 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
ACE P12821 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALOX15 P16050 2/20 0.45
CYP3A4 P08684 1/20 0.45
LMNA P02545 2/20 0.43
KLKB1 P03952 1/20 0.43
CTSS P25774 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSK P43235 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL30259421 0.96 REN (0.50) RENUSP2ACEMEN1KMT2A
SCHEMBL23023028 0.86 KLKB1 (0.51) HPGDMEN1KMT2AKLKB1CTSS
SCHEMBL3794340 0.86 KLKB1 (0.51) HPGDMEN1KMT2AKLKB1CTSS
Hydrochloric Acid SCHEMBL23004846 0.85 KLKB1 (0.50) HPGDMEN1KMT2AKLKB1CTSS
SCHEMBL19974930 0.84 LTA4H (0.50) USP2ALDH1A1HPGDACEKLKB1
SCHEMBL15649130 0.81 CTSK (0.60) CTSSCTSLCTSBCTSK
SCHEMBL23004918 0.80 LTA4H (0.55) HPGDACEKLKB1CTSSCTSL
SCHEMBL11896293 0.80 LTA4H (0.55) HPGDACEKLKB1CTSSCTSL
SCHEMBL11896295 0.80 LTA4H (0.55) HPGDACEKLKB1CTSSCTSL
SCHEMBL13915549 0.79 MMP8 (0.56) L3MBTL1SMN1; SMN2PPIDMMP8EPHX2

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 REN 817/4885USP2 3098/4885ALDH1A1 2271/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C REN 1020/4885USP2 3054/4885ALDH1A1 2673/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C REN 817/4885USP2 3098/4885ALDH1A1 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.