SCHEMBL1744537

SCHEMBL1744537

Cc1cc(-c2c(-c3cccnc3)nc3ccc(N4CCN[C@@H](C)C4)nn23)ccn1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 10/20 0.67
RIPK3 Q9Y572 4/20 0.43
ACVR1 Q04771 1/20 0.39
PIM1 P11309 4/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCD Q05655 1/20 0.38

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
SCHEMBL3107152 0.91 CSNK1E (0.78) CSNK1ERIPK3PIM1PRKCQPRKCD
SCHEMBL3107143 0.91 CSNK1E (0.78) CSNK1ERIPK3PIM1PRKCQPRKCD
SCHEMBL1744422 0.90 CSNK1E (0.76) CSNK1ERIPK3
SCHEMBL1746059 0.89 CSNK1E (0.84) CSNK1ERIPK3
SCHEMBL1743950 0.88 CSNK1E (0.66) CSNK1ERIPK3ACVR1PIM1
SCHEMBL1744710 0.87 CSNK1E (0.66) CSNK1ERIPK3PIM1
SCHEMBL477036 0.85 CSNK1E (0.59) CSNK1EACVR1PIM1PRKCQPRKCD
SCHEMBL477034 0.85 CSNK1E (0.59) CSNK1EACVR1PIM1PRKCQPRKCD
SCHEMBL1744597 0.81 RIPK3 (0.49) CSNK1ERIPK3ACVR1
SCHEMBL477110 0.81 CSNK1E (0.55) CSNK1EACVR1PRKCQPRKCD

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