SCHEMBL2713263

SCHEMBL2713263

Cc1c(-c2ccc(N3CCNCC3)nc2)nc2cc(F)cc(F)c2c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.45
KCNH2 Q12809 1/20 0.40
CACNA1C Q13936 1/20 0.40
ASIC3 Q9UHC3 1/20 0.40
TLR9 Q9NR96 1/20 0.40
TLR8 Q9NR97 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
ALK Q9UM73 1/20 0.40
NMT1 P30419 1/20 0.39
RET P07949 2/20 0.39
BMPR1B O00238 1/20 0.38
BMPR1A P36894 1/20 0.38
ACVR1B P36896 1/20 0.38
ACVR1 Q04771 1/20 0.38
FAAH O00519 1/20 0.38
NTRK1 P04629 3/20 0.38
HDAC2 Q92769 1/20 0.38
PIK3CA P42336 1/20 0.37
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37

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
SCHEMBL2711862 0.91 CNR2 (0.46) TLR9TLR8TLR7RETPIK3CA
SCHEMBL13063871 0.91 KCNH2 (0.42) JAK2KCNH2CACNA1CASIC3TLR9
SCHEMBL2711326 0.90 CNR2 (0.48) TLR9TLR8TLR7ACVR1PIK3CA
SCHEMBL2711514 0.89 TDO2 (0.44) JAK2KCNH2TLR9TLR8TLR7
SCHEMBL2712479 0.88 CNR2 (0.48) KCNH2PIK3CACNR2
SCHEMBL2711279 0.87 PIK3CA (0.38) JAK2KCNH2PIK3CACNR2
SCHEMBL2711214 0.87 HDAC6 (0.39) KCNH2CNR2
SCHEMBL2713583 0.86 NMT1 (0.43) TLR9TLR8TLR7NMT1ATR
SCHEMBL13019432 0.83 CNR2 (0.37) KCNH2ACVR1PIK3CACNR2
SCHEMBL2712369 0.83 MELK (0.39) KCNH2RETCNR2

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 JAK2 85/4885KCNH2 3410/4885CACNA1C 3980/4885

“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.