SCHEMBL4692194

SCHEMBL4692194

COCCN1C(=O)C(Nc2c(C(C)=O)cc3coccc2-3)=C(c2ccccc2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 8/20 0.38
NR1H3 Q13133 8/20 0.38
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 1/20 0.33
NAT1 P18440 1/20 0.32
RAB9A P51151 1/20 0.32
NR4A2 P43354 1/20 0.32
NPC1 O15118 1/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL4692192 0.80 NR1H2 (0.43) NR1H2NR1H3ALDH1A1
SCHEMBL4689718 0.72 NR1H2 (0.55) NR1H2NR1H3ALDH1A1KMT2A
SCHEMBL4692190 0.71 NR1H2 (0.45) NR1H2NR1H3ALDH1A1LMNASMN1; SMN2
SCHEMBL4687894 0.69 NR1H2 (0.76) NR1H2NR1H3ALDH1A1LMNASMN1; SMN2
SCHEMBL5746128 0.68 NR1H2 (0.51) NR1H2NR1H3ALDH1A1SMN1; SMN2KMT2A
SCHEMBL5737209 0.67 PTGS2 (0.49) NR1H2NR1H3ALDH1A1LMNASMN1; SMN2
SCHEMBL4688674 0.67 NR1H2 (0.56) NR1H2NR1H3SMN1; SMN2
SCHEMBL4689410 0.66 NR1H2 (0.51) NR1H2NR1H3ALDH1A1RAB9A
SCHEMBL4688571 0.65 NR1H2 (0.58) NR1H2NR1H3ALDH1A1LMNASMN1; SMN2
SCHEMBL5790936 0.64 NR1H2 (0.67) NR1H2NR1H3ALDH1A1LMNASMN1; SMN2

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
EP-1646626-B1 PYRROLE-2, 5-DIONE DERIVATIVES AS LIVER X RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2008-07-02 EP claimed
US-20060235015-A1 Pyrrole-2,5-dione derivatives as liver x receptor modulators ASTRAZENECA AB (SE) 2006-10-19 US claimed
US-7432288-B2 Pyrrole-2,5-dione derivatives as Liver X receptor modulators ASTRAZENECA AB (SE) 2008-10-07 US disclosed
EP-1646626-B1 PYRROLE-2, 5-DIONE DERIVATIVES AS LIVER X RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2008-07-02 EP disclosed
US-20060235015-A1 Pyrrole-2,5-dione derivatives as liver x receptor modulators ASTRAZENECA AB (SE) 2006-10-19 US disclosed
EP-1646626-A1 PYRROLE-2, 5-DIONE DERIVATIVES AS LIVER X RECEPTOR MODULATORS AstraZeneca AB (SE) 2006-04-19 EP disclosed
WO-2005005417-A1 PYRROLE-2, 5-DIONE DERIVATIVES AS LIVER X RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2005-01-20 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-20060235015-A1 Pyrrole-2,5-dione derivatives as liver x receptor modulators NR1H2, NR1H3, SREBF2 NR1H2 1/4885NR1H3 2/4885ALDH1A1 3161/4885

“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.