SCHEMBL2127756

SCHEMBL2127756

CC(=O)N1CCS(=O)(=O)c2ccc(N3CCOCC3)cc21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.47
PIK3CA P42336 4/20 0.44
LGMN Q99538 3/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PSMD14 O00487 1/20 0.40
KMO O15229 1/20 0.40
GAA P10253 1/20 0.40
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
PIK3CG P48736 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ATM Q13315 2/20 0.39
EPHX1 P07099 1/20 0.39

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
SCHEMBL2126434 0.76 HSD17B3 (0.41) MAPTMEN1KMT2A
SCHEMBL2608566 0.75 NOTUM (0.57) PRKDCLGMNMAPTMEN1KMT2A
SCHEMBL5065354 0.73 PRKDC (0.50) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL2126046 0.71 PIK3CA (0.44) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL2123409 0.71 NOTUM (0.52) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL2124487 0.69 PIK3CA (0.49) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL2724366 0.69 PRKDC (0.46) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL2123764 0.69 PSMD14 (0.43) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL20097525 0.67 PRKDC (0.68) PRKDCPIK3CALGMNMAPTMEN1
SCHEMBL21172640 0.67 PRKDC (0.46) PRKDCLGMNMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
US-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
EP-2445902-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES AS INHIBITORS OF PI3K ACTIVITY Amgen, Inc (US) 2012-05-02 EP disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 US disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 US disclosed
WO-2010151737-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-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 PRKDC 30/4885PIK3CA 28/4885LGMN 3555/4885

“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.