SCHEMBL2725899

SCHEMBL2725899

Cc1c(-c2cccc3c2cnn3C)nc2cc(F)cc(F)c2c1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.37
PIK3CA P42336 2/20 0.37
FAAH O00519 2/20 0.35
PDE10A Q9Y233 2/20 0.34
RORC P51449 2/20 0.33
CCR4 P51679 1/20 0.33
KRAS P01116 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
ABL1 P00519 1/20 0.32
CYP17A1 P05093 1/20 0.32
CYP1A2 P05177 1/20 0.32
SLC34A1 Q06495 2/20 0.32
DHODH Q02127 1/20 0.31
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31

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
SCHEMBL2728036 0.84 HSD11B1 (0.42) PIK3CAPDE10ADHODH
SCHEMBL2123097 0.81 PIK3CA (0.46) KDRPIK3CAPDE10ADHODH
SCHEMBL2727749 0.79 PIK3CD (0.51) PIK3CA
SCHEMBL2711810 0.78 MBNL1 (0.37) PIK3CAPDE10ADHODH
SCHEMBL2710938 0.78 MBNL1 (0.48) PIK3CAPDE10ADHODH
SCHEMBL2126067 0.76 PIK3CA (0.49) KDRPIK3CAABL1
SCHEMBL2123958 0.75 PIK3CA (0.35) PIK3CAPDE10ADHODH
SCHEMBL2713623 0.75 PDE10A (0.43) PIK3CAPDE10ADHODH
SCHEMBL2713030 0.71 PDE10A (0.42) PDE10ACYP17A1CYP1A2
SCHEMBL2712894 0.71 MBNL1 (0.33) PIK3CAPDE10ADHODH

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 KDR 1702/4885PIK3CA 29/4885FAAH 1263/4885

“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.