SCHEMBL18652476

SCHEMBL18652476

CCc1ccnc(Nc2cccc(-c3cnc(N4CCN(N)C(=O)C4(C)C)o3)c2)n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.45
▸ ABL1 P00519 2/20 0.38
▸ BCR P11274 1/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ SMG1 Q96Q15 4/20 0.37
▸ CDK1 P06493 3/20 0.37
▸ CDK2 P24941 3/20 0.37
▸ MTOR P42345 2/20 0.37
▸ JAK2 O60674 7/20 0.37
▸ JAK3 P52333 5/20 0.37
▸ JAK1 P23458 2/20 0.37
▸ CAMK2D Q13557 1/20 0.36
▸ TYK2 P29597 3/20 0.36
▸ ABL2 P42684 1/20 0.36
▸ CSF1R P07333 1/20 0.35
▸ ULK2 Q8IYT8 1/20 0.35
▸ TBK1 Q9UHD2 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
SCHEMBL18627938 0.87 SYK (0.57) SYKABL1BCRBRD4SMG1
SCHEMBL18652487 0.86 SYK (0.45) SYKSMG1CDK1CDK2MTOR
SCHEMBL17113590 0.81 SYK (0.69) SYKABL1BCRBRD4SMG1
SCHEMBL18627957 0.77 SYK (0.45) SYKABL1BCRBRD4SMG1
SCHEMBL18627953 0.76 SYK (0.61) SYKABL1BCRSMG1CDK1
SCHEMBL18627929 0.75 SYK (0.57) SYKABL1BCRSMG1CDK1
SCHEMBL18627919 0.75 SYK (0.43) SYKABL1BCRBRD4SMG1
SCHEMBL18652274 0.75 SYK (0.58) SYKABL1BCRSMG1CDK1
SCHEMBL18627934 0.75 SYK (0.56) SYKABL1BCRSMG1CDK1
SCHEMBL18640375 0.74 SYK (0.41) SYKABL1BCRBRD4SMG1

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