SCHEMBL1613780

SCHEMBL1613780

COCCN(C)C1CCn2c1c(-c1ccncn1)c1cc(Br)ccc12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.35
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CHI3L1 P36222 1/20 0.32
POLB P06746 1/20 0.30
HTT P42858 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
SCHEMBL12713873 1.00 DYRK1A (0.35) DYRK1AMEN1KMT2ACHI3L1POLB
SCHEMBL12713874 1.00 DYRK1A (0.35) DYRK1AMEN1KMT2ACHI3L1POLB
SCHEMBL12713872 1.00 DYRK1A (0.35) DYRK1AMEN1KMT2ACHI3L1POLB
SCHEMBL12743899 0.80 KCNH2 (0.35) CHI3L1
SCHEMBL12743878 0.80 KCNH2 (0.35) CHI3L1
SCHEMBL12743894 0.80 KCNH2 (0.35) CHI3L1
SCHEMBL4427384 0.77 MAP3K14 (0.45)
SCHEMBL12714631 0.77 MAP3K14 (0.45)
SCHEMBL4566789 0.77 MAP3K14 (0.45)
SCHEMBL1613547 0.77 MAP3K14 (0.45)

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-2315751-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS Amgen Inc. (US) 2011-05-04 EP disclosed
US-20110086834-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS AMGEN INC. (US) 2011-04-14 US disclosed
WO-2009158011-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS AMGEN INC. (US) 2009-12-30 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-20110086834-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS NFKBIA, MAP3K1, MAP3K2 DYRK1A 1111/4885MEN1 4123/4885KMT2A 2087/4885

“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.