SCHEMBL2712930

SCHEMBL2712930

Cc1c(-c2cncc(F)c2)nc2cc(F)ccc2c1Cl

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.44
CYP11B2 P19099 8/20 0.44
CYP17A1 P05093 2/20 0.41
CYP3A4 P08684 1/20 0.41
NQO2 P16083 1/20 0.39
ADORA2B P29275 1/20 0.39
DHODH Q02127 6/20 0.38
MPO P05164 1/20 0.37
PIM1 P11309 1/20 0.36
TDO2 P48775 1/20 0.36
CYP19A1 P11511 1/20 0.36
ABL1 P00519 1/20 0.36
ACHE P22303 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
SCHEMBL2711571 0.89 DHODH (0.46) CYP11B1CYP11B2CYP17A1CYP3A4DHODH
SCHEMBL2124665 0.85 KDM4C (0.50) CYP11B1CYP11B2CYP17A1CYP3A4NQO2
SCHEMBL2124769 0.84 DHODH (0.50) CYP11B1CYP11B2DHODHTDO2CYP19A1
SCHEMBL2123766 0.83 MAPK14 (0.52) DHODHMPO
SCHEMBL2123245 0.82 PIK3CA (0.41) DHODHMPOACHE
SCHEMBL2123397 0.79 PIK3CA (0.42) DHODHMPOABL1ACHE
SCHEMBL2125696 0.78 PIK3CA (0.44) CYP11B1CYP11B2CYP17A1CYP3A4NQO2
SCHEMBL2124656 0.77 PIK3CA (0.46) CYP3A4DHODHMPOACHE
SCHEMBL2712817 0.76 CYP11B1 (0.40) CYP11B1CYP11B2CYP17A1CYP3A4NQO2
SCHEMBL2125622 0.75 PIK3CA (0.47) CYP11B1CYP11B2CYP17A1CYP3A4NQO2

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 CYP11B1 1418/4885CYP11B2 1364/4885CYP17A1 2205/4885

“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.