SCHEMBL10085705

SCHEMBL10085705

COc1cc(N2CCc3nc(N)sc3C2)cnc1Cl

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 8/20 0.67
PIK3CD O00329 1/20 0.55
JAK2 O60674 1/20 0.49
CHRNB2 P17787 2/20 0.46
CHRNA4 P43681 2/20 0.46
RAD52 P43351 1/20 0.41
RECQL P46063 1/20 0.41
CFTR P13569 1/20 0.35

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
SCHEMBL171588 0.88 PIK3CG (0.67) PIK3CGPIK3CDJAK2RAD52RECQL
SCHEMBL10086558 0.78 PIK3CG (0.77) PIK3CGPIK3CDJAK2CFTR
SCHEMBL608796 0.78 PIK3CG (0.66) PIK3CGCHRNB2CHRNA4RAD52RECQL
SCHEMBL10085390 0.78 PIK3CG (0.80) PIK3CGPIK3CDJAK2CHRNB2CHRNA4
SCHEMBL10085393 0.77 PIK3CG (0.79) PIK3CGPIK3CDJAK2CHRNB2CHRNA4
SCHEMBL10085376 0.76 PIK3CG (0.77) PIK3CGPIK3CDJAK2
SCHEMBL10085391 0.76 PIK3CG (0.76) PIK3CGPIK3CDJAK2
SCHEMBL10085383 0.75 PIK3CG (0.78) PIK3CGPIK3CDJAK2CFTR
SCHEMBL10085384 0.75 PIK3CG (0.75) PIK3CGPIK3CDJAK2
SCHEMBL10085369 0.75 PIK3CD (0.79) PIK3CGPIK3CDJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120039849-A1 TETRAHYDROTHIAZOLOPYRIDINE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-02-16 US disclosed
WO-2010096389-A1 TETRAHYDROTHIAZOLOPYRIDINE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-08-26 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 (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-20120039849-A1 TETRAHYDROTHIAZOLOPYRIDINE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE PIK3CA, PIK3CD, PIK3CG PIK3CG 3/4885PIK3CD 2/4885JAK2 38/4885

“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.