SCHEMBL2124665

SCHEMBL2124665

Cc1c(-c2cncc(F)c2)nc2cnccc2c1Cl

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.50
PIK3CA P42336 3/20 0.45
DHODH Q02127 5/20 0.41
CYP11B1 P15538 5/20 0.41
CYP11B2 P19099 5/20 0.41
CYP17A1 P05093 2/20 0.41
CYP3A4 P08684 1/20 0.40
NQO2 P16083 1/20 0.39
ADORA2B P29275 1/20 0.39
RORC P51449 1/20 0.39
MAPK14 Q16539 1/20 0.37
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
PIM1 P11309 1/20 0.35
PARP10 Q53GL7 1/20 0.35
PARP11 Q9NR21 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
SCHEMBL2126711 0.89 PIK3CA (0.43) KDM4CPIK3CADHODHCYP3A4RORC
SCHEMBL2608586 0.86 DHODH (0.42) KDM4CPIK3CADHODHCYP11B1CYP11B2
SCHEMBL2712930 0.85 CYP11B1 (0.44) DHODHCYP11B1CYP11B2CYP17A1CYP3A4
SCHEMBL2711571 0.83 DHODH (0.46) DHODHCYP11B1CYP11B2CYP17A1CYP3A4
SCHEMBL2125622 0.77 PIK3CA (0.47) PIK3CADHODHCYP11B1CYP11B2CYP17A1
SCHEMBL2124769 0.75 DHODH (0.50) PIK3CADHODHCYP11B1CYP11B2RORC
SCHEMBL2712817 0.75 CYP11B1 (0.40) PIK3CADHODHCYP11B1CYP11B2CYP17A1
SCHEMBL2125696 0.75 PIK3CA (0.44) PIK3CACYP11B1CYP11B2CYP17A1CYP3A4
SCHEMBL2123766 0.74 MAPK14 (0.52) PIK3CADHODHMAPK14CSNK2A2CSNK2B
SCHEMBL2711938 0.73 DHODH (0.58) DHODHCYP11B1CYP11B2RORC

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
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
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
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
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 KDM4C 1935/4885PIK3CA 28/4885DHODH 2656/4885

“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.