SCHEMBL18640240

SCHEMBL18640240

CCC1CNCCN1c1ncc(-c2cccc(Nc3nccc(C)n3)c2)o1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 2/20 0.42
▸ SYK P43405 4/20 0.42
▸ ROCK1 Q13464 1/20 0.38
▸ CAMK2D Q13557 1/20 0.37
▸ JAK2 O60674 2/20 0.36
▸ BRD4 O60885 2/20 0.36
▸ CHRNA7 P36544 2/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ SMG1 Q96Q15 1/20 0.35
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ ACVR1 Q04771 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
SCHEMBL18640412 0.89 SYK (0.44) ROCK2SYKROCK1CAMK2DJAK2
SCHEMBL18627939 0.84 SYK (0.47) ROCK2SYKROCK1CAMK2DJAK2
SCHEMBL18640375 0.82 SYK (0.41) ROCK2SYKROCK1CAMK2DJAK2
SCHEMBL18627956 0.81 SYK (0.49) SYKCAMK2DBRD4CDK1CDK2
SCHEMBL18627914 0.81 SYK (0.49) SYKCAMK2DBRD4CDK1CDK2
SCHEMBL18627901 0.81 SYK (0.49) SYKCAMK2DBRD4CDK1CDK2
SCHEMBL18627908 0.79 SYK (0.47) SYKBRD4CDK1CDK2SMG1
SCHEMBL18627910 0.79 SYK (0.47) SYKBRD4CDK1CDK2SMG1
SCHEMBL18627951 0.79 SYK (0.47) SYKBRD4CDK1CDK2SMG1
SCHEMBL18627954 0.79 SYK (0.45) SYKJAK2CDK1CDK2SMG1

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-3350176-A1 NOVEL OXAZOLE DERIVATIVES THAT INHIBIT SYK AB Science (FR) 2018-07-25 — — EP claimed
WO-2017046302-A1 NOVEL OXAZOLE DERIVATIVES THAT INHIBIT SYK AB SCIENCE (FR) 2017-03-23 — — WO claimed
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