SCHEMBL1300328

SCHEMBL1300328

COc1ccc(N)cc1-n1c(CSc2ncnc3[nH]cnc23)nc2cccc(Cl)c2c1=O

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 11/20 0.64
PIK3CD O00329 8/20 0.64
PIK3CB P42338 3/20 0.64
POLB P06746 2/20 0.46
RECQL P46063 1/20 0.46
GAA P10253 1/20 0.40
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PIK3R1 P27986 4/20 0.37
PIK3CA P42336 2/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL12105287 0.92 PIK3CG (0.64) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL1497355 0.91 PIK3CG (0.62) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL369837 0.91 PIK3CG (0.77) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL19198778 0.90 PIK3CG (0.62) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL1299798 0.90 PIK3CG (0.61) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL1300314 0.89 PIK3CG (0.60) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL12832378 0.89 PIK3CG (0.58) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL19198821 0.88 PIK3CG (0.59) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL19199369 0.87 PIK3CG (0.58) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL1299500 0.87 PIK3CG (0.58) PIK3CGPIK3CDPIK3CBPOLBRECQL

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
US-11542492-B2 Ligand-directed covalent modification of protein CELGENE CAR LLC (BM) 2023-01-03 US disclosed
US-11542492-B2 Ligand-directed covalent modification of protein CELGENE CAR LLC (BM) 2023-01-03 US disclosed
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein CELGENE CAR LLC (BM) 2017-08-03 US disclosed
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein CELGENE CAR LLC (BM) 2017-08-03 US disclosed
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein CELGENE CAR LLC (BM) 2017-08-03 US disclosed
EP-2519664-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN Avila Therapeutics, Inc. (US) 2012-11-07 EP disclosed
US-20110269244-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN CELGENE CAR LLC (BM) 2011-11-03 US disclosed
US-20110269244-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN CELGENE CAR LLC (BM) 2011-11-03 US disclosed
US-20110269244-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN CELGENE CAR LLC (BM) 2011-11-03 US disclosed
WO-2011082285-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN AVILA THERAPEUTICS, INC. (US) 2011-07-07 WO disclosed
WO-2011082285-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN AVILA THERAPEUTICS, INC. (US) 2011-07-07 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-11542492-B2 Ligand-directed covalent modification of protein PTMS, SPR, DNPEP PIK3CG 4388/4885PIK3CD 4347/4885PIK3CB 4185/4885
US-20110269244-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN PTMS, SPR, DNPEP PIK3CG 4388/4885PIK3CD 4347/4885PIK3CB 4185/4885
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein PTMS, SPR, DNPEP PIK3CG 4388/4885PIK3CD 4347/4885PIK3CB 4185/4885

“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.