SCHEMBL17328337

SCHEMBL17328337

CC(C)(C)C(=O)Nc1cc(-c2cn3nc(N4CCC[C@H](O)C4)ccc3n2)ccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 2/20 0.41
IRAK4 Q9NWZ3 5/20 0.40
CLK2 P49760 3/20 0.37
LRRK2 Q5S007 3/20 0.37
KCNH2 Q12809 1/20 0.37
SCN5A Q14524 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
RET P07949 1/20 0.37
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
CSNK1D P48730 1/20 0.35
CSNK1E P49674 1/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
CCNC P24863 2/20 0.35
CDK8 P49336 2/20 0.35
FGFR3 P22607 1/20 0.35
KDR P35968 1/20 0.35

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
SCHEMBL9956186 1.00 RBP4 (0.41) RBP4IRAK4CLK2LRRK2KCNH2
SCHEMBL17328321 1.00 RBP4 (0.41) RBP4IRAK4CLK2LRRK2KCNH2
SCHEMBL9955490 0.95 CLK2 (0.40) RBP4IRAK4CLK2LRRK2KCNH2
SCHEMBL9956873 0.95 CLK2 (0.40) RBP4IRAK4CLK2LRRK2KCNH2
SCHEMBL17328315 0.95 CLK2 (0.40) RBP4IRAK4CLK2LRRK2KCNH2
SCHEMBL9956651 0.91 RBP4 (0.41) RBP4IRAK4CLK2LRRK2KCNH2
SCHEMBL9956696 0.91 RBP4 (0.42) RBP4CLK2LRRK2KCNH2SCN5A
SCHEMBL9955993 0.90 RBP4 (0.40) RBP4CLK2LRRK2KCNH2SCN5A
SCHEMBL9956228 0.89 RBP4 (0.45) RBP4RXFP1CSNK1DCSNK1E
SCHEMBL9957202 0.88 DPP4 (0.42) RBP4IRAK4CLK2LRRK2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2635578-B1 2-ARYLIMIDAZO[1,2-B]PYRIDAZINE, 2-PHENYLIMIDAZO[1,2-A]PYRIDINE, AND 2-PHENYLIMIDAZO[1,2-A]PYRAZINE DERIVATIVES HENGRUI USA LTD (US) 2015-12-16 EP disclosed