SCHEMBL1621876

SCHEMBL1621876

CC(=O)Nc1nc2ccc(-c3cnc(Cl)c(OC(C)C#N)c3)cc2s1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 7/20 0.63
PIK3CG P48736 6/20 0.60
SMO Q99835 2/20 0.57
RIPK1 Q13546 2/20 0.55
AKT1 P31749 2/20 0.55
CYP3A4 P08684 1/20 0.55

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
SCHEMBL1619960 0.90 PIK3CG (0.66) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1622185 0.87 PIK3CG (0.64) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1620223 0.85 PIK3CA (0.55) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1621112 0.85 PIK3CG (0.79) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1620033 0.84 PIK3CG (0.68) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1619561 0.83 PIK3CG (0.69) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1621507 0.79 SMO (0.68) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1621635 0.79 PIK3CA (0.71) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1621665 0.78 PIK3CA (0.73) PIK3CAPIK3CGSMORIPK1AKT1
SCHEMBL1621000 0.78 PIK3CG (0.69) PIK3CAPIK3CGSMORIPK1AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2183232-B1 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2013-03-06 EP claimed
EP-2183232-A2 PI3 KINASE MODULATORS AND METHODS OF USE Amgen, Inc (US) 2010-05-12 EP claimed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US claimed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 WO claimed
EP-2183232-B1 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2013-03-06 EP disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
EP-2183232-A2 PI3 KINASE MODULATORS AND METHODS OF USE Amgen, Inc (US) 2010-05-12 EP disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 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-20090054405-A1 PI3 kinase modulators and methods of use PIK3CA, PIK3C2A, PIK3C2B PIK3CA 1/4885PIK3CG 5/4885SMO 2761/4885

“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.