SCHEMBL248369

SCHEMBL248369

CCN(C(C)C)C(C)C.Clc1ncnc2[nH]cnc12

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.31
▸ FGFR1 P11362 1/20 0.30
▸ FGFR4 P22455 1/20 0.30

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
Trimethylammonium SCHEMBL8826193 0.81 CHEK1 (0.38) CHEK1
SCHEMBL30942632 0.80 CHEK1 (0.42) CHEK1FGFR1
SCHEMBL9081 0.80 CHEK1 (0.42) CHEK1FGFR1
SCHEMBL8716026 0.79 CHEK1 (0.41) CHEK1FGFR1
SCHEMBL9798919 0.79 CHEK1 (0.41) CHEK1FGFR1
Hydrochloric Acid SCHEMBL11162213 0.79 CHEK1 (0.41) CHEK1FGFR1
SCHEMBL248371 0.77 HTT (0.46) CHEK1
SCHEMBL11167998 0.76 CHEK1 (0.35) CHEK1FGFR1
Acetone SCHEMBL3279080 0.74 CHEK1 (0.36) CHEK1FGFR1FGFR4
SCHEMBL253743 0.71 KDM4A (0.32) —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588469-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY Amgen Inc. (US) 2013-05-08 — — EP disclosed
US-20130096134-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-18 — — US disclosed
WO-2012003271-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 — — 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-20130096134-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, SSB, MALT1 CHEK1 1319/4885FGFR1 3186/4885FGFR4 3142/4885

“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.

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