SCHEMBL890481

SCHEMBL890481

CC(c1nc2ccccn2c(=O)c1-c1ccccc1S(C)(=O)=O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 9/20 0.54
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
HTR6 P50406 1/20 0.38
BRD9 Q9H8M2 1/20 0.38
BAZ2B Q9UIF8 1/20 0.38
BAZ2A Q9UIF9 1/20 0.38
POLB P06746 1/20 0.37
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 3/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPGD P15428 2/20 0.35
HIF1A Q16665 1/20 0.35
USP2 O75604 1/20 0.35
CASP1 P29466 1/20 0.35
HTT P42858 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
SCHEMBL890536 0.85 PIK3CD (0.59) PIK3CDHSP90AA1HSP90AB1HTR6BRD9
SCHEMBL890545 0.83 KDM4E (0.44) PIK3CDHSP90AA1HSP90AB1HTR6POLB
SCHEMBL890589 0.79 HSP90AA1 (0.42) HSP90AA1HSP90AB1HTR6KDM4EALDH1A1
SCHEMBL890633 0.76 PIK3CD (0.68) PIK3CD
SCHEMBL2715344 0.74 PIK3CD (0.49) PIK3CDHSP90AA1HSP90AB1HTR6BRD9
SCHEMBL890646 0.71 PIK3CD (1.00) PIK3CD
SCHEMBL890702 0.71 PIK3CD (1.00) PIK3CD
SCHEMBL10119947 0.69 PIK3CD (0.43) PIK3CDHSP90AA1HSP90AB1KDM4EALDH1A1
SCHEMBL10120340 0.68 PIK3CD (0.36) PIK3CDHSP90AA1HSP90AB1KDM4EALDH1A1
SCHEMBL17718331 0.67 PIK3CD (0.46) PIK3CDPOLBALDH1A1NPSR1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754089-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-06-17 US disclosed
US-8754089-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-06-17 US disclosed
US-8754089-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-06-17 US disclosed
EP-2445898-A2 4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES AS PI3K INHIBITORS Amgen, Inc (US) 2012-05-02 EP disclosed
US-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-05 US disclosed
US-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-05 US disclosed
WO-2010151735-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 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-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 PIK3CD 24/4885HSP90AA1 1973/4885HSP90AB1 1328/4885

“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.