SCHEMBL48302

SCHEMBL48302

COc1ccc(-c2sc(NC(C)=O)nc2C)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.78
ALDH1A1 P00352 4/20 0.78
GAA P10253 4/20 0.78
LMNA P02545 3/20 0.78
KDM4E B2RXH2 2/20 0.78
PIK3CG P48736 10/20 0.71
PIK3CD O00329 9/20 0.71
PIK3CA P42336 8/20 0.71
PIK3CB P42338 8/20 0.71
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
HPGD P15428 3/20 0.63
ADORA3 P0DMS8 1/20 0.58
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HTT P42858 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
DYRK1A Q13627 2/20 0.54
CYP1A2 P05177 1/20 0.54

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
SCHEMBL12991171 0.84 ALDH1A1 (0.61) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL48461 0.84 PIK3CG (0.76) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL49804 0.83 ABL1 (0.64) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL48393 0.83 PIK3CG (0.74) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL48942 0.83 PIK3CG (1.00) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL48767 0.83 PIK3CD (0.66) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL12992093 0.82 PIK3CG (0.74) MAPTALDH1A1GAALMNAPIK3CG
SCHEMBL48710 0.82 PIK3CG (0.82) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL924922 0.82 PIK3CG (0.61) MAPTALDH1A1GAALMNAKDM4E
SCHEMBL6546546 0.82 MAPT (0.88) MAPTALDH1A1GAALMNAKDM4E

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 12 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-8344153-B2 Inhibitors of phosphatidylinositol 3-kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-01 US 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-20100316605-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-16 US disclosed
WO-2010144513-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-16 WO 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 (3 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 MAPT 1132/4885ALDH1A1 3271/4885GAA 2233/4885
US-20050119320-A1 5-phenylthiazole derivatives and use as pi3 kinase inhibitors PIK3CA, PIK3R5, PIP5K1B MAPT 1132/4885ALDH1A1 3271/4885GAA 2233/4885
US-20100316605-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE PIK3CA, PIK3CG, PIK3CD MAPT 2849/4885ALDH1A1 4418/4885GAA 367/4885

“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.