SCHEMBL1398048

SCHEMBL1398048

Cc1cccc2c1CN(C1CC(=O)NC1=O)C=N2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 7/20 0.39
DDB1 Q16531 5/20 0.39
RAB9A P51151 1/20 0.34
CREBBP Q92793 3/20 0.34
BRD4 O60885 1/20 0.33
CYP1A2 P05177 2/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CHRM2 P08172 1/20 0.33
OPRM1 P35372 1/20 0.33
IKZF3 Q9UKT9 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
BLM P54132 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
IDO1 P14902 1/20 0.32
MAP1LC3B Q9GZQ8 1/20 0.32

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
SCHEMBL5216374 0.88 CRBN (0.48) CRBNDDB1BRD4CYP1A2TSHR
SCHEMBL1398147 0.85 CRBN (0.44) CRBNDDB1RAB9ACREBBPBRD4
SCHEMBL1398075 0.85 LMNA (0.44) CRBNDDB1RAB9ABRD4CYP1A2
SCHEMBL1398069 0.85 CRBN (0.39) CRBNDDB1RAB9ABRD4CYP1A2
SCHEMBL1398032 0.85 CRBN (0.44) CRBNDDB1RAB9ABRD4CYP1A2
SCHEMBL1398034 0.85 CRBN (0.35) CRBNDDB1RAB9ABRD4CYP1A2
SCHEMBL1398056 0.84 CREBBP (0.37) CRBNDDB1CREBBPTSHRALDH1A1
Hydrochloric Acid SCHEMBL1398070 0.84 CRBN (0.43) CRBNDDB1RAB9ABRD4CYP1A2
Hydrochloric Acid SCHEMBL1398149 0.84 CRBN (0.44) CRBNDDB1RAB9ACREBBPBRD4
SCHEMBL1398107 0.82 CRBN (0.44) CRBNDDB1RAB9AALDH1A1CHRM2

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
EP-1957481-B1 PYRROLIDIN(THI)ONES HETEROCYCLICALLY SUBSTITUTED IN 3-POSITION GRUENENTHAL GMBH (DE) 2011-03-02 EP claimed
US-20080293749-A1 Pyrrolidine(thi)ones Substituted by Heterocyclic Substituents in The 3-Position GRUENENTHAL GMBH (DE) 2008-11-27 US claimed
EP-1957481-B1 PYRROLIDIN(THI)ONES HETEROCYCLICALLY SUBSTITUTED IN 3-POSITION GRUENENTHAL GMBH (DE) 2011-03-02 EP disclosed
US-20080293749-A1 Pyrrolidine(thi)ones Substituted by Heterocyclic Substituents in The 3-Position GRUENENTHAL GMBH (DE) 2008-11-27 US disclosed
EP-1957481-A1 PYRROLIDIN(THI)ONES HETEROCYCLICALLY SUBSTITUTED IN 3-POSITION Grünenthal GmbH (DE) 2008-08-20 EP disclosed
WO-2007062817-A1 PYRROLIDIN(THI)ONES HETEROCYCLICALLY SUBSTITUTED IN 3-POSITION Grünenthal GmbH (DE) 2007-06-07 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 (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-20080293749-A1 Pyrrolidine(thi)ones Substituted by Heterocyclic Substituents in The 3-Position TPMT, MALT1, THPO CRBN 1317/4885DDB1 1517/4885RAB9A 1269/4885

“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.