SCHEMBL6206939

SCHEMBL6206939

C1=CNc2sc3cccnc3c2C=C1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.36
▸ CLK1 P49759 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
SCHEMBL10054253 0.67 LIMK1 (0.57) LIMK1CLK1
SCHEMBL1809291 0.60 CA12 (0.31) —
SCHEMBL21315925 0.59 LIMK1 (0.36) LIMK1CLK1
SCHEMBL17051494 0.59 LIMK1 (0.49) LIMK1CLK1
SCHEMBL27174136 0.59 GPR3 (0.54) LIMK1CLK1
SCHEMBL149872 0.59 GPR3 (0.54) LIMK1CLK1
SCHEMBL19486448 0.58 LIMK1 (0.35) LIMK1CLK1
SCHEMBL9836884 0.58 LIMK1 (0.59) LIMK1CLK1
SCHEMBL9050404 0.58 LIMK1 (0.43) LIMK1CLK1
SCHEMBL8121883 0.58 LIMK1 (0.43) LIMK1CLK1

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-1546134-A1 PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES ELI LILLY AND COMPANY (US) 2005-06-29 — — EP disclosed
WO-2004014895-A1 PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES ELI LILLY AND COMPANY (US) 2004-02-19 — — WO disclosed
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