SCHEMBL7089313

SCHEMBL7089313

Cc1csc(-c2cccc(C(=O)C(O)c3ccccc3)c2-c2ccc(Br)s2)c1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 4/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
EIF4E P06730 1/20 0.33
CES2 O00748 1/20 0.32
LMNA P02545 1/20 0.32
CES1 P23141 1/20 0.32
GAA P10253 1/20 0.32
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KCNH2 Q12809 1/20 0.30
SCN5A Q14524 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL7088052 0.82 RXFP1 (0.35) RXFP1KMT2AMEN1EIF4ECES2
SCHEMBL7091319 0.79 TTR (0.34) KDM4E
SCHEMBL7089475 0.78 AKR1C3 (0.33) KMT2AMEN1CES2LMNACES1
SCHEMBL7087779 0.77 ALDH1A1 (0.44) KMT2AMEN1GAAKEAP1NFE2L2
SCHEMBL7090216 0.74 CTSA (0.36) KMT2AMEN1
SCHEMBL7085135 0.73 TNF (0.39) LMNAGAAALDH1A1KDM4E
SCHEMBL7090550 0.73 AKR1C3 (0.37) GAAALDH1A1KDM4E
SCHEMBL11627037 0.65 L3MBTL1 (0.50) KMT2AMEN1CES2LMNACES1
SCHEMBL3462461 0.65 MYC (0.67) KMT2AMEN1CES2LMNACES1
SCHEMBL7090554 0.64 NPSR1 (0.37) KMT2AMEN1CES2LMNACES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation G.D. SEARLE & CO. 2003-03-13 US disclosed
US-6426360-B1 ANTIARTHRITIC AGENTS G D SEARLE & CO. 2002-07-30 US disclosed
EP-0772601-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003387-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 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-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation AHR, HACL2, IRAK2 RXFP1 2420/4885KMT2A 2522/4885MEN1 4791/4885

“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.