SCHEMBL49804

SCHEMBL49804

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

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.64
GSK3A P49840 1/20 0.57
GSK3B P49841 1/20 0.57
ALDH1A1 P00352 5/20 0.55
MAPT P10636 4/20 0.55
KDM4E B2RXH2 3/20 0.55
GAA P10253 3/20 0.55
LMNA P02545 2/20 0.55
PIK3CA P42336 4/20 0.53
PIK3CG P48736 4/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HPGD P15428 2/20 0.51
HTT P42858 1/20 0.51
PIK3CD O00329 3/20 0.51
PIK3CB P42338 3/20 0.51

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
SCHEMBL6285228 0.84 MAPT (0.63) ABL1ALDH1A1MAPTKDM4EGAA
SCHEMBL48302 0.83 MAPT (0.78) ALDH1A1MAPTKDM4EGAALMNA
SCHEMBL12992210 0.82 GSK3B (0.68) GSK3AGSK3BALDH1A1MAPTKDM4E
SCHEMBL48623 0.82 PIK3CD (0.72) ABL1PIK3CAPIK3CGNPC1RAB9A
SCHEMBL6546188 0.81 MAPT (0.60) ABL1ALDH1A1MAPTKDM4EGAA
SCHEMBL12991262 0.80 PIK3CG (0.55) GSK3AGSK3BALDH1A1MAPTKDM4E
SCHEMBL48463 0.79 PI4KB (0.60) PIK3CAPIK3CGPIK3CDPI4KB
SCHEMBL48560 0.79 PI4KB (0.60) PIK3CAPIK3CGPIK3CDPI4KB
SCHEMBL49374 0.76 ABL1 (0.50) ABL1ALDH1A1PIK3CAPIK3CGNPC1
SCHEMBL6546415 0.75 MAPT (0.61) ABL1ALDH1A1MAPTKDM4EGAA

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
EP-2311818-B1 Combination of a 5-phenylthiazole compound as PI3 kinase inhibitor with an antiinflammatory, bronchodilatory or antihistamine drug NOVARTIS AG (CH) 2013-01-16 EP disclosed
US-8129541-B2 5-phenylthiazole derivatives and use as PI3 kinase inhibitors NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-1480962-B1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS NOVARTIS AG (CH) 2011-08-24 EP disclosed
EP-2311818-A1 Combination of a 5-phenylthiazole compound as PI3 kinase inhibitor with an antiinflammatory, bronchodilatory or antihistamine drug Novartis AG (CH) 2011-04-20 EP disclosed
US-20100093690-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS BRUCE IAN 2010-04-15 US disclosed
US-7687637-B2 5-phenylthiazole derivatives and use as Pi3 kinase inhibitors NOVARTIS AG (CH) 2010-03-30 US disclosed
US-20050119320-A1 5-phenylthiazole derivatives and use as pi3 kinase inhibitors NOVARTIS AG (CH) 2005-06-02 US disclosed
EP-1480962-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS Novartis AG (CH) 2004-12-01 EP disclosed
WO-2003072557-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS NOVARTIS AG (CH) 2003-09-04 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 (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-20100093690-A1 5-PHENYLTHIAZOLE DERIVATIVES AND USE AS PI3 KINASE INHIBITORS PIK3CA, PIK3R5, PIP5K1B ABL1 134/4885GSK3A 364/4885GSK3B 291/4885
US-20050119320-A1 5-phenylthiazole derivatives and use as pi3 kinase inhibitors PIK3CA, PIK3R5, PIP5K1B ABL1 134/4885GSK3A 364/4885GSK3B 291/4885

“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.