SCHEMBL18652274

SCHEMBL18652274

CC1(C)C(=O)NCCN1c1ncc(-c2cccc(Nc3nccc(O)n3)c2)o1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 6/20 0.58
▸ JAK2 O60674 4/20 0.37
▸ JAK3 P52333 3/20 0.36
▸ TYK2 P29597 2/20 0.36
▸ CCNT1 O60563 2/20 0.36
▸ CDK9 P50750 2/20 0.36
▸ PLK1 P53350 2/20 0.36
▸ JAK1 P23458 2/20 0.36
▸ ABL1 P00519 2/20 0.35
▸ BCR P11274 2/20 0.35
▸ SMG1 Q96Q15 2/20 0.35
▸ CAMK2D Q13557 1/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ MARK3 P27448 1/20 0.34

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
SCHEMBL18627953 0.91 SYK (0.61) SYKJAK2JAK3TYK2CCNT1
SCHEMBL18627906 0.88 SYK (0.57) SYKJAK2JAK3TYK2CCNT1
SCHEMBL18627938 0.88 SYK (0.57) SYKJAK2JAK3TYK2CCNT1
SCHEMBL18627929 0.88 SYK (0.57) SYKJAK2TYK2CCNT1CDK9
SCHEMBL18627898 0.88 SYK (0.56) SYKJAK2SMG1CAMK2DCDK1
SCHEMBL18627945 0.88 SYK (0.56) SYK
SCHEMBL18627897 0.88 SYK (0.56) SYKJAK2JAK3TYK2CCNT1
SCHEMBL18627934 0.88 SYK (0.56) SYKJAK2JAK3TYK2CCNT1
SCHEMBL18627911 0.86 SYK (0.58) SYKJAK2JAK3TYK2CCNT1
SCHEMBL18627907 0.86 SYK (0.54) SYKJAK2JAK3CCNT1CDK9

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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