SCHEMBL7140438

SCHEMBL7140438

Cc1nc(NC(=N)N)sc1-c1ccc(Cl)c(N)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.51
PIK3CG P48736 15/20 0.51
PIK3CA P42336 11/20 0.51
PIK3CB P42338 10/20 0.51
PI4KB Q9UBF8 4/20 0.45
PIK3C3 Q8NEB9 3/20 0.45
PIK3C2A O00443 1/20 0.45
PIK3C2B O00750 1/20 0.45
PI4KA P42356 1/20 0.45
PRKDC P78527 1/20 0.45
XIAP P98170 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
RCE1 Q9Y256 1/20 0.39
CYP3A4 P08684 1/20 0.38

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
SCHEMBL3602935 0.82 PIK3CD (0.48) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL3608584 0.81 PIK3CG (0.51) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
Hydrochloric Acid SCHEMBL7142142 0.80 PIK3CD (0.50) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL7141961 0.80 PIK3CG (0.41) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL13074374 0.80 PIK3CD (0.52) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL3596697 0.80 XIAP (0.47) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
Hydrochloric Acid SCHEMBL7140582 0.79 XIAP (0.46) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL48462 0.78 PIK3CG (0.69) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL11080713 0.76 XIAP (0.48) PIK3CDPIK3CGPIK3CAPIK3CBPI4KB
SCHEMBL3606518 0.75 MEN1 (0.50) PIK3CDPIK3CGPIK3CAPIK3CBXIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0928790-B1 Thiazole derivatives HOFFMANN LA ROCHE (CH) 2003-03-05 EP disclosed
CN-1080720-C Thiazole derivatives HOFFMANN LA ROCHE (CH) 2002-03-13 CN disclosed
US-6344562-B1 ANTITUMOR AGENTS HOFFMANN-LA ROCHE INC. 2002-02-05 US disclosed
US-20020010316-A1 Thiazole derivatives ALIG LEO (CH) 2002-01-24 US disclosed
US-6320054-B1 INHIBIT BINDING OF ADHESIVE PROTEINS TO THE SURFACE OF DIFFERENT TYPES F CELL AND ACCORDINGLY INFLUENCE CELL-CELL AND CELL-MATRIX INTERACTIONS. HOFFMAN-LA ROCHE INC. 2001-11-20 US disclosed
US-6100282-A Thiazole derivatives HOFFMAN-LA ROCHE INC. (US) 2000-08-08 US disclosed
CN-1224718-A Thiazole derivatives HOFFMANN LA ROCHE (CH) 1999-08-04 CN disclosed
EP-0928790-A1 Thiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-07-14 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-20020010316-A1 Thiazole derivatives VCAM1, SOST, TGFB1 PIK3CD 3749/4885PIK3CG 3998/4885PIK3CA 2428/4885

“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.