SCHEMBL49374

SCHEMBL49374

CCNC(=O)Nc1nc(C)c(-c2cccc(N)c2)s1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
XIAP P98170 1/20 0.48
PIK3CD O00329 6/20 0.44
PIK3CA P42336 6/20 0.44
PIK3CB P42338 6/20 0.44
PIK3CG P48736 6/20 0.44
PI4KB Q9UBF8 3/20 0.44
CYP3A4 P08684 1/20 0.42
CLK1 P49759 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
CLK2 P49760 1/20 0.42
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41

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
SCHEMBL7139963 0.87 LCK (0.54) NPC1RAB9AXIAPPI4KBCYP3A4
SCHEMBL12992183 0.84 PIK3CG (0.60) XIAPPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL48750 0.82 MAPT (0.50) ABL1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL6068147 0.80 ABL1 (0.79) ABL1SMN1; SMN2NPC1RAB9APIK3CD
SCHEMBL3596697 0.79 XIAP (0.47) SMN1; SMN2NPC1RAB9AXIAPPIK3CD
SCHEMBL48602 0.79 PIK3CD (0.55) ABL1PIK3CDPIK3CAPIK3CBPIK3CG
Hydrochloric Acid SCHEMBL7140582 0.78 XIAP (0.46) SMN1; SMN2NPC1RAB9AXIAPPIK3CD
SCHEMBL48896 0.77 PIK3CD (0.62) PIK3CDPIK3CAPIK3CBPIK3CGPI4KB
SCHEMBL49804 0.76 ABL1 (0.64) ABL1SMN1; SMN2NPC1RAB9APIK3CD
SCHEMBL7139996 0.76 CFTR (0.45) NPC1RAB9AXIAPPIK3CDPIK3CA

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 11 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
CN-100548996-C 5-phenylthiazole derivatives and their use for the preparation of medicaments NOVARTIS AG (CH) 2009-10-14 CN disclosed
CN-1639139-A 5-phenylthiazole derivatives and use as PI3 kinase inhibitors NOVARTIS AG (CH) 2005-07-13 CN 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 134/4885SMN1; SMN2 2920/4885NPC1 2181/4885
US-20050119320-A1 5-phenylthiazole derivatives and use as pi3 kinase inhibitors PIK3CA, PIK3R5, PIP5K1B ABL1 134/4885SMN1; SMN2 2920/4885NPC1 2181/4885

“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.