SCHEMBL324558

SCHEMBL324558

Cc1n[nH]cc1CC(=O)N1CCN(c2ncnc3[nH]ccc23)CC2(CC2)C1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 16/20 0.58
LCK P06239 1/20 0.47
KIT P10721 3/20 0.46
JAK1 P23458 1/20 0.45

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
SCHEMBL324612 0.84 JAK3 (0.61) JAK3LCKKITJAK1
SCHEMBL327123 0.83 JAK3 (0.59) JAK3LCKKIT
SCHEMBL327055 0.83 JAK3 (0.59) JAK3LCKKITJAK1
SCHEMBL10232195 0.83 JAK3 (0.56) JAK3LCKKITJAK1
SCHEMBL324140 0.83 JAK3 (0.58) JAK3LCKKITJAK1
SCHEMBL327058 0.83 JAK3 (0.58) JAK3LCKKIT
SCHEMBL323281 0.82 JAK3 (0.60) JAK3LCKKIT
SCHEMBL10231884 0.82 JAK3 (0.69) JAK3LCKKIT
SCHEMBL322701 0.82 JAK3 (0.57) JAK3LCKKIT
SCHEMBL323328 0.82 JAK3 (0.57) JAK3LCKKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590981-A1 NOVEL HOMOPIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2013-05-15 EP claimed
WO-2012003829-A1 NOVEL HOMOPIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2012-01-12 WO claimed
EP-2590981-A1 NOVEL HOMOPIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2013-05-15 EP disclosed
WO-2012003829-A1 NOVEL HOMOPIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2012-01-12 WO disclosed