SCHEMBL492983

SCHEMBL492983

Cc1cc(C)c(S(=O)(=O)N(C)CCOCC(=O)NCC2CCC(C(c3cccs3)N(C)C)CC2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 14/20 0.40
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PKM P14618 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL493535 0.93 BDKRB1 (0.48) BDKRB1
SCHEMBL493214 0.92 BDKRB1 (0.43) BDKRB1GLAMAPTL3MBTL1PKM
SCHEMBL492502 0.90 BDKRB1 (0.39) BDKRB1MEN1KMT2ALMNA
SCHEMBL492731 0.89 BDKRB1 (0.41) BDKRB1
SCHEMBL493577 0.89 POLB (0.41) MEN1KMT2AL3MBTL1PKMLMNA
SCHEMBL492795 0.87 BDKRB1 (0.51) BDKRB1
SCHEMBL492497 0.85 MEN1 (0.36) MEN1KMT2AMAPTPKMTP53
SCHEMBL492401 0.85 POLB (0.40) MAPTPKMLMNATP53
SCHEMBL492638 0.85 ALDH1A1 (0.45) PKMLMNATP53
SCHEMBL492753 0.84 TRPV4 (0.36) BDKRB1MAPTL3MBTL1PKMLMNA

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 BDKRB1 1622/4885MEN1 4132/4885KMT2A 1749/4885

“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.