SCHEMBL19974775

SCHEMBL19974775

COc1ccc(F)cc1N(C=O)C(C)C(=O)C(=O)NCc1cccc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
OPRL1 P41146 1/20 0.42
CTSD P07339 1/20 0.41
APEX1 P27695 1/20 0.40
NR3C1 P04150 1/20 0.38
PDE10A Q9Y233 1/20 0.38
POLB P06746 2/20 0.38
CCNT1 O60563 1/20 0.38
CDK9 P50750 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
ADRA1D P25100 1/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38

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
SCHEMBL21176358 0.93 OPRM1 (0.42) OPRM1OPRL1CTSDAPEX1PDE10A
SCHEMBL21183519 0.91 CTSD (0.43) CTSDAPEX1PDE10AALDH1A1LMNA
SCHEMBL19975540 0.91 CTSD (0.43) CTSDAPEX1PDE10AALDH1A1LMNA
SCHEMBL19975059 0.91 CTSD (0.43) CTSDAPEX1PDE10AALDH1A1LMNA
SCHEMBL19975389 0.85 CTSD (0.42) OPRM1OPRL1CTSDAPEX1NR3C1
SCHEMBL21176223 0.84 METAP2 (0.41) ALDH1A1
SCHEMBL19975394 0.83 TACR1 (0.39) ALDH1A1LMNA
SCHEMBL19975413 0.83 MEN1 (0.41) LMNA
SCHEMBL30061813 0.83 MEN1 (0.41) LMNA
SCHEMBL19974810 0.81 POLB (0.48) POLBALDH1A1PKM

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 OPRM1 2692/4885OPRL1 1821/4885CTSD 922/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C OPRM1 2605/4885OPRL1 1762/4885CTSD 1046/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C OPRM1 2692/4885OPRL1 1821/4885CTSD 922/4885

“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.