SCHEMBL1745927

SCHEMBL1745927

c1cc(-c2nc3ccc(N4CCC(N5CCCC5)CC4)nn3c2-c2ccncc2)ccn1

nearest known ligand 0.92

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 11/20 0.92
RIPK3 Q9Y572 7/20 0.53
DYRK3 O43781 1/20 0.45
CCNT1 O60563 1/20 0.45
CDK9 P50750 1/20 0.45
DYRK1A Q13627 1/20 0.45
DYRK2 Q92630 1/20 0.45
DYRK1B Q9Y463 1/20 0.45
HASPIN Q8TF76 1/20 0.44

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
SCHEMBL3118856 0.96 CSNK1E (1.00) CSNK1ERIPK3DYRK3CCNT1CDK9
SCHEMBL3119337 0.94 CSNK1E (1.00) CSNK1ERIPK3
SCHEMBL3119317 0.91 CSNK1E (0.77) CSNK1ERIPK3DYRK3CCNT1CDK9
SCHEMBL3729274 0.91 CSNK1E (0.77) CSNK1ERIPK3DYRK3CCNT1CDK9
SCHEMBL17976955 0.90 CSNK1E (0.93) CSNK1ERIPK3
SCHEMBL3106595 0.89 CSNK1E (0.91) CSNK1ERIPK3
SCHEMBL3116053 0.88 CSNK1E (0.79) CSNK1ERIPK3DYRK3CCNT1CDK9
SCHEMBL3725856 0.88 CSNK1E (0.75) CSNK1ERIPK3DYRK3CCNT1CDK9
SCHEMBL477099 0.88 CSNK1E (0.72) CSNK1ERIPK3DYRK3CCNT1CDK9
SCHEMBL3114292 0.87 CSNK1E (0.83) CSNK1ERIPK3HASPIN

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-2385946-A1 DERIVATIVES OF 6-CYCLOAMINO-2,3-DI-PYRIDINYL-IMIDAZO[1,2-B]-PYRIDAZINE, PREPARATION AND TUERAPEUTIC APPLICATION THEREOF SANOFI (FR) 2011-11-16 EP disclosed
US-8040450-B2 Liquid crystal electro-optic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2011-10-18 US disclosed
WO-2010070238-A1 DERIVATIVES OF 6-CYCLOAMINO-2,3-DI-PYRIDINYL-IMIDAZO[1,2-B]-PYRIDAZINE, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2010-06-24 WO disclosed