SCHEMBL1704290

SCHEMBL1704290

Cc1c(Nc2cnccn2)nc(-c2ccnc(N3CCNCC3)c2)c(C)c1N

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 17/20 0.62
NMT1 P30419 1/20 0.41
DYRK1A Q13627 1/20 0.40
ATR Q13535 1/20 0.40

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
SCHEMBL1704904 0.86 KARS1 (0.68) KARS1NMT1DYRK1AATR
SCHEMBL1704095 0.78 KARS1 (0.62) KARS1
SCHEMBL1704222 0.77 KARS1 (1.00) KARS1
SCHEMBL901708 0.75 KARS1 (0.66) KARS1DYRK1A
SCHEMBL902600 0.74 KARS1 (1.00) KARS1
SCHEMBL1704254 0.74 KARS1 (0.59) KARS1NMT1ATR
SCHEMBL1755643 0.73 KARS1 (1.00) KARS1
SCHEMBL901826 0.73 KARS1 (0.60) KARS1
SCHEMBL902386 0.72 KARS1 (0.75) KARS1
SCHEMBL1755689 0.72 KARS1 (0.75) KARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP claimed
EP-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP disclosed