SCHEMBL6285228

SCHEMBL6285228

CCNC(=O)Nc1nc(-c2ccc(OC)cc2)c(-c2ccncc2)s1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.63
ALDH1A1 P00352 4/20 0.63
KDM4E B2RXH2 4/20 0.63
LMNA P02545 3/20 0.63
GAA P10253 3/20 0.63
ABL1 P00519 4/20 0.59
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
PTGS2 P35354 3/20 0.57
ADORA3 P0DMS8 1/20 0.53
ADORA2B P29275 1/20 0.53
ROCK2 O75116 1/20 0.53
ROCK1 Q13464 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
RECQL P46063 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
THRB P10828 1/20 0.52
PIK3CA P42336 1/20 0.52
PIK3CG P48736 1/20 0.52
HTT P42858 2/20 0.50

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
SCHEMBL6546415 0.91 MAPT (0.61) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6546252 0.86 MAPT (0.66) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6546188 0.86 MAPT (0.60) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6546278 0.86 ABL1 (0.54) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6546691 0.86 ABL1 (0.54) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6546546 0.85 MAPT (0.88) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6546740 0.84 MAPT (0.63) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6280826 0.84 MAPT (0.66) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL49804 0.84 ABL1 (0.64) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL6282486 0.83 MAPT (0.67) MAPTALDH1A1KDM4ELMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6962933-B1 Method for inhibiting p38 MAP kinase or TNF-α production using a 1,3-thiazole TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-08 US disclosed
US-20050080113-A1 Medicinal compositions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-14 US disclosed
US-20040097555-A1 Concomitant drugs TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-20 US disclosed
EP-1402900-A1 MEDICINAL COMPOSITIONS Takeda Chemical Industries, Ltd. (JP) 2004-03-31 EP disclosed
EP-1027050-B1 1,3-THIAZOLES AS ADENOSINE A3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF ALLERGY, ASTHMA AND DIABETES TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-01-14 EP disclosed
EP-1354603-A1 CONCOMITANT DRUGS Takeda Chemical Industries, Ltd. (JP) 2003-10-22 EP disclosed
US-6620825-B1 1,3-Azole compound substituted by pyridyl; administering as antiasthmatic, antiinflammatory or antiallergen agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-09-16 US disclosed
US-6436966-B1 Adenosine A3 receptor antagonists TAKEDA CHEMICAL IND., LTD. (JP) 2002-08-20 US disclosed
EP-1205478-A1 p38MAP KINASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2002-05-15 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 (2 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-20050080113-A1 Medicinal compositions TNF, TRAF6, MMP8 MAPT 2844/4885ALDH1A1 3345/4885KDM4E 4034/4885
US-20040097555-A1 Concomitant drugs TNF, CHUK, CNKSR1 MAPT 2113/4885ALDH1A1 3292/4885KDM4E 2889/4885

“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.