SCHEMBL2712469

SCHEMBL2712469

Cc1c(-c2cc(F)ccc2S(C)(=O)=O)nc2cc(F)cc(F)c2c1Cl

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 7/20 0.42
PIK3CD O00329 3/20 0.42
CCR2 P41597 1/20 0.39
RXFP1 Q9HBX9 1/20 0.34
PTGS1 P23219 2/20 0.33
PTGS2 P35354 2/20 0.33
EPAS1 Q99814 2/20 0.33
DHODH Q02127 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32

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
SCHEMBL2125697 0.92 PIK3CA (0.49) PIK3CAPIK3CDCCR2PTGS2EPAS1
SCHEMBL248485 0.88 PIK3CA (0.47) PIK3CAPIK3CDPTGS1PTGS2DHODH
SCHEMBL2710901 0.87 PIK3CA (0.39) PIK3CAPIK3CDCCR2EPAS1
SCHEMBL2711674 0.86 PIK3CA (0.39) PIK3CAPIK3CDEPAS1DHODH
SCHEMBL2710904 0.86 PIK3CA (0.39) PIK3CAPIK3CDCCR2
SCHEMBL2711237 0.79 ALOX5AP (0.35) DHODHALOX5APFEN1
SCHEMBL2710938 0.76 MBNL1 (0.48) PIK3CAPIK3CDPTGS1DHODH
SCHEMBL2713623 0.76 PDE10A (0.43) PIK3CAPTGS1PTGS2DHODH
SCHEMBL2123517 0.75 PIK3CA (0.49) PIK3CAPIK3CDRXFP1PTGS2DHODH
SCHEMBL2711810 0.74 MBNL1 (0.37) PIK3CADHODHKMT2A

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
EP-2445886-B1 4-AMINOQUINOLINE DERIVATIVES AS PI3K INHIBITORS AMGEN INC (US) 2016-03-30 EP disclosed
EP-2445886-B1 4-AMINOQUINOLINE DERIVATIVES AS PI3K INHIBITORS AMGEN INC (US) 2016-03-30 EP disclosed
US-8940724-B2 Quinoline derivitives and their uses AMGEN INC. (US) 2015-01-27 US disclosed
US-8940724-B2 Quinoline derivitives and their uses AMGEN INC. (US) 2015-01-27 US disclosed
US-8940724-B2 Quinoline derivitives and their uses AMGEN INC. (US) 2015-01-27 US disclosed
EP-2445886-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen, Inc (US) 2012-05-02 EP disclosed
US-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 US disclosed
US-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 US disclosed
US-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 US disclosed
WO-2010151791-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 WO disclosed
WO-2010151791-A1 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-20100331293-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 PIK3CA 29/4885PIK3CD 14/4885CCR2 459/4885

“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.