SCHEMBL902280

SCHEMBL902280

O[C@H]1CC[C@H](Nc2cc(Cl)nc(Cl)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 6/20 0.42
EGFR P00533 3/20 0.42
PIM2 Q9P1W9 3/20 0.42
MAPK8 P45983 3/20 0.42
CDC7 O00311 3/20 0.42
CHEK1 O14757 2/20 0.42
MAPK13 O15264 2/20 0.42
PDPK1 O15530 2/20 0.42
DAPK3 O43293 2/20 0.42
DYRK3 O43781 2/20 0.42
JAK2 O60674 2/20 0.42
PRKD3 O94806 2/20 0.42
PAK4 O96013 2/20 0.42
PRKCG P05129 2/20 0.42
CDK1 P06493 2/20 0.42
FES P07332 2/20 0.42
CSF1R P07333 2/20 0.42
ROS1 P08922 2/20 0.42
FER P16591 2/20 0.42
PRKACA P17612 2/20 0.42

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
SCHEMBL902281 1.00 PIM1 (0.42) PIM1EGFRPIM2MAPK8CDC7
SCHEMBL26604133 0.81 CDC7 (0.54) PIM1EGFRPIM2MAPK8CDC7
SCHEMBL7790533 0.81 MEN1 (0.41) PIM1EGFRPIM2CDK1INSR
SCHEMBL26604152 0.76 LCK (0.50) PIM1EGFRPIM2MAPK8CDC7
SCHEMBL21997528 0.76 S1PR2 (0.41) CSNK2A1S1PR2
SCHEMBL901805 0.76 PDGFRB (0.50) GSK3BPDGFRADYRK1AS1PR2PDGFRB
SCHEMBL901803 0.76 PDGFRB (0.50) GSK3BPDGFRADYRK1AS1PR2PDGFRB
SCHEMBL22081785 0.75 TP53 (0.40) PIM1EGFRPIM2MAPK8CDK1
SCHEMBL935044 0.75 CDC7 (0.46) PIM1EGFRPIM2MAPK8CDC7
SCHEMBL7790017 0.73 MAPK14 (0.37) PIM1EGFRCDC7CDK1INSR

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 disclosed
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO disclosed