SCHEMBL3784744

SCHEMBL3784744

Cc1c(N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)nc2cc(F)cc(F)c2c1Nc1cncc(N2CCOCC2)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 15/20 0.50
PIK3CD O00329 1/20 0.38
USP30 Q70CQ3 1/20 0.37
GPR119 Q8TDV5 2/20 0.37
AKT1 P31749 1/20 0.35
MTOR P42345 1/20 0.35
EGFR P00533 1/20 0.34

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
SCHEMBL3784969 1.00 PIK3CA (0.50) PIK3CAPIK3CDUSP30GPR119AKT1
SCHEMBL3784742 1.00 PIK3CA (0.50) PIK3CAPIK3CDUSP30GPR119AKT1
SCHEMBL3785083 0.93 PIK3CA (0.49) PIK3CAPIK3CD
SCHEMBL3785084 0.93 PIK3CA (0.49) PIK3CAPIK3CD
SCHEMBL2711557 0.90 PIK3CA (0.42) PIK3CAPIK3CD
SCHEMBL2712547 0.90 PIK3CA (0.42) PIK3CAPIK3CD
SCHEMBL2712900 0.90 PIK3CA (0.42) PIK3CAPIK3CD
SCHEMBL2712367 0.90 PIK3CA (0.60) PIK3CAPIK3CD
SCHEMBL3775860 0.88 PIK3CA (0.48) PIK3CAPIK3CD
SCHEMBL3784844 0.88 PIK3CA (0.48) PIK3CAPIK3CD

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 9 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
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

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 14/4885USP30 1120/4885

“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.