SCHEMBL18640412

SCHEMBL18640412

Cc1ccnc(Nc2cccc(-c3cnc(N4CCNC[C@@H]4C)o3)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.44
▸ ROCK1 Q13464 6/20 0.40
▸ ROCK2 O75116 5/20 0.40
▸ WEE1 P30291 4/20 0.40
▸ CAMK2D Q13557 1/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ CDK1 P06493 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ SMG1 Q96Q15 1/20 0.36
▸ LATS1 O95835 1/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ PIM3 Q86V86 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36

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
SCHEMBL18640240 0.89 ROCK2 (0.42) SYKROCK1ROCK2CAMK2DJAK2
SCHEMBL18640375 0.89 SYK (0.41) SYKROCK1ROCK2WEE1CAMK2D
SCHEMBL18627901 0.85 SYK (0.49) SYKCAMK2DBRD4CDK1CDK2
SCHEMBL18627914 0.85 SYK (0.49) SYKCAMK2DBRD4CDK1CDK2
SCHEMBL18627956 0.85 SYK (0.49) SYKCAMK2DBRD4CDK1CDK2
SCHEMBL18627951 0.81 SYK (0.47) SYKBRD4CDK1CDK2SMG1
SCHEMBL18627910 0.81 SYK (0.47) SYKBRD4CDK1CDK2SMG1
SCHEMBL18627908 0.81 SYK (0.47) SYKBRD4CDK1CDK2SMG1
SCHEMBL18627939 0.81 SYK (0.47) SYKROCK1ROCK2CAMK2DJAK2
SCHEMBL14673604 0.81 JAK2 (0.48) SYKJAK2BRD4CDK1CDK2

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 disclosed
WO-2017046302-A1 NOVEL OXAZOLE DERIVATIVES THAT INHIBIT SYK AB SCIENCE (FR) 2017-03-23 — — WO disclosed
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