SCHEMBL13154269

SCHEMBL13154269

Brc1ccc(-c2ccnc(Nc3ccc4c(c3)CCN4)n2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 6/20 0.40
▸ IKBKB O14920 5/20 0.39
▸ DKK1 O94907 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ CHUK O15111 2/20 0.39
▸ IKBKG Q9Y6K9 2/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ CDC7 O00311 1/20 0.37
▸ CDK4 P11802 3/20 0.37
▸ CDK2 P24941 3/20 0.37
▸ CLK1 P49759 1/20 0.37
▸ CLK2 P49760 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ CLK4 Q9HAZ1 1/20 0.37
▸ DYRK1B Q9Y463 1/20 0.37
▸ AURKA O14965 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ CDK7 P50613 1/20 0.37
▸ CDK9 P50750 1/20 0.37

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
SCHEMBL12423145 0.83 SYK (0.57) SYKIKBKBDKK1GSK3BCHUK
SCHEMBL12423159 0.76 IKBKB (0.49) SYKIKBKBDKK1GSK3BCDK4
SCHEMBL12423187 0.75 CLK1 (0.67) SYKGSK3BCDK4CDK2CLK1
SCHEMBL12423190 0.75 SYK (0.58) SYKIKBKBDKK1GSK3BJAK2
SCHEMBL12423172 0.75 PIK3CG (0.52) SYKIKBKBCDK4CDK2CDK1
SCHEMBL12423171 0.74 IKBKB (0.55) SYKIKBKBDKK1GSK3BCDK4
SCHEMBL12423166 0.74 SYK (0.58) SYKIKBKBDKK1GSK3BCHUK
SCHEMBL12423191 0.74 MEN1 (0.55) SYKIKBKBDKK1GSK3BCHUK
SCHEMBL12423169 0.74 CDK2 (0.53) SYKIKBKBDKK1GSK3BJAK2
SCHEMBL12423148 0.73 ZAP70 (0.61) SYKIKBKBDKK1GSK3BCDK4

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
US-7803806-B2 Pyrimidinyl-thiophene kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-09-28 — — US disclosed
US-7803806-B2 Pyrimidinyl-thiophene kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-09-28 — — US disclosed
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