SCHEMBL493908

SCHEMBL493908

Cc1cc(C)c(S(=O)(=O)N2CCC(OCC(=O)NC3CCC(C(c4cccc(F)c4)N(C)C)CC3)C2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 16/20 0.41
PKM P14618 2/20 0.38
TSHR P16473 1/20 0.38
OPRL1 P41146 1/20 0.37
EBP Q15125 1/20 0.36
DHCR7 Q9UBM7 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
SCHEMBL493194 0.94 BDKRB1 (0.39) EPHX2PKMTSHROPRL1
SCHEMBL493537 0.92 EPHX2 (0.41) EPHX2PKMEBPDHCR7
SCHEMBL492906 0.92 EPHX2 (0.47) EPHX2EBPDHCR7
SCHEMBL493569 0.90 PKM (0.42) PKMTSHR
SCHEMBL492666 0.90 EPHX2 (0.38) EPHX2PKMTSHROPRL1
SCHEMBL493249 0.90 EPHX2 (0.42) EPHX2EBPDHCR7
SCHEMBL493121 0.89 PKM (0.49) PKMTSHROPRL1
SCHEMBL492826 0.89 PKM (0.44) EPHX2PKMTSHR
SCHEMBL493902 0.89 EPHX2 (0.42) EPHX2
SCHEMBL492967 0.87 KMT2A (0.42) PKMTSHROPRL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US claimed
EP-2139851-A2 SUBSTITUTED AMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-01-06 EP claimed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US claimed
WO-2008131946-A2 SUBSTITUTED AMIDE DERIVATIVES Grünenthal GmbH (DE) 2008-11-06 WO claimed
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US 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 (1 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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD EPHX2 2567/4885PKM 1161/4885TSHR 4051/4885

“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.