SCHEMBL19975199

SCHEMBL19975199

CC(C)C(C(O)C(=O)NCC1CC1)N(C=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 5/20 0.39
F10 P00742 2/20 0.37
PRSS1 P07477 2/20 0.37
KMT2A Q03164 3/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.37
BCHE P06276 3/20 0.37
GAA P10253 1/20 0.36
GPR88 Q9GZN0 1/20 0.36

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
SCHEMBL19975274 0.89 PTGIR (0.41) PTGIRF10PRSS1KMT2ACYP2C19
SCHEMBL19974728 0.85 BCHE (0.42) PTGIRKMT2AMEN1ALDH1A1BCHE
SCHEMBL19975353 0.85 BCHE (0.45) KMT2AMEN1ALDH1A1BCHEGAA
SCHEMBL19975370 0.85 PTGIR (0.40) PTGIRCYP2C19ALDH1A1BCHEGPR88
SCHEMBL21176166 0.84 BCHE (0.46) KMT2AMEN1ALDH1A1BCHEGAA
SCHEMBL19974852 0.83 GPR88 (0.42) PTGIRCYP2C19ALDH1A1BCHEGPR88
SCHEMBL19975529 0.80 PTGIR (0.40) PTGIRCYP3A4CYP2C19ALDH1A1TSHR
SCHEMBL19975143 0.79 PTGIR (0.43) PTGIRF10PRSS1KMT2ACYP2C9
SCHEMBL28315915 0.78 F10 (0.39) F10PRSS1ALDH1A1GAA
SCHEMBL19975134 0.78 PTGIR (0.40) PTGIRF10PRSS1KMT2AALDH1A1

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 PTGIR 540/4885F10 1167/4885PRSS1 347/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C PTGIR 679/4885F10 1141/4885PRSS1 433/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C PTGIR 540/4885F10 1167/4885PRSS1 347/4885

“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.