SCHEMBL7085313

SCHEMBL7085313

COc1ccc(-c2nc(SC)n(C)c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.59
MAPK13 O15264 6/20 0.59
MAPK12 P53778 6/20 0.59
MAPK11 Q15759 6/20 0.59
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 3/20 0.48
NPC1 O15118 3/20 0.48
MAPT P10636 2/20 0.48
MAPK1 P28482 1/20 0.47
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TEK Q02763 1/20 0.44
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL11016914 0.81 KMT2A (0.43) MAPK14MAPK13MAPK12MAPK11RAB9A
SCHEMBL10966368 0.81 LMNA (0.50) MAPK14MAPK13MAPK12MAPK11RAB9A
SCHEMBL10964771 0.80 MEN1 (0.48) MAPK14MAPK13MAPK12MAPK11RAB9A
SCHEMBL10809999 0.79 VCP (0.44) MAPK14MAPK13MAPK12MAPK11RAB9A
SCHEMBL10989518 0.78 ALDH1A1 (0.47) RAB9ALMNANPC1MAPTKDM4E
SCHEMBL5443200 0.78 ALDH1A1 (0.47) LMNAMAPTKDM4EALDH1A1NPSR1
SCHEMBL13937116 0.76 LMNA (0.60) RAB9ASMN1; SMN2LMNANPC1MAPT
SCHEMBL5451982 0.75 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL10915111 0.74 ALDH1A1 (0.66) RAB9ASMN1; SMN2LMNANPC1MAPT
SCHEMBL9539522 0.73 NPSR1 (0.50) RAB9ASMN1; SMN2LMNANPC1MAPT

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-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation G.D. SEARLE & CO. 2003-03-13 US disclosed
EP-0772601-B1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-09-18 EP disclosed
US-6426360-B1 ANTIARTHRITIC AGENTS G D SEARLE & CO. 2002-07-30 US disclosed
EP-1211244-A2 4,5-substitued imidazolyl compounds for the treatment of inflammation G.D. Searle & Co. (US) 2002-06-05 EP disclosed
US-5620999-A ANTIARTHRITIC, ANALGESIC AND ANTIPYRATIC AGENT G.D. SEARLE & CO. 1997-04-15 US disclosed
EP-0046451-A2 Diaryl-imidazole compounds, methods for their preparation, pharmaceutical drugs containing them and their use CIBA-GEIGY AG (CH) 1982-02-24 EP 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 MAPK14 1523/4885MAPK13 2251/4885MAPK12 2078/4885

“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.