SCHEMBL15076876

SCHEMBL15076876

C=C(OC)c1c(-c2ccncc2)[nH]c(-c2ccncc2)c1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.64
CSNK1D P48730 1/20 0.64
CLK2 P49760 1/20 0.64
CSNK1G1 Q9HCP0 1/20 0.64
CDC7 O00311 5/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
RAF1 P04049 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 1/20 0.38
TUBA1A Q71U36 1/20 0.38
TUBA1C Q9BQE3 1/20 0.38

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
SCHEMBL15076886 0.85 CSNK1A1 (0.57) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL7686242 0.84 CSNK1A1 (0.73) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL15076904 0.83 CSNK1A1 (0.73) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL15076903 0.82 CSNK1A1 (0.54) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL7680958 0.79 CSNK1A1 (0.66) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL15076919 0.78 CSNK1D (0.65) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL7685369 0.78 CSNK1A1 (1.00) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL15074517 0.77 CSNK1A1 (0.63) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
SCHEMBL4183351 0.77 CSNK1D (0.73) CSNK1A1CSNK1DCLK2CSNK1G1CDC7
Hydrochloric Acid SCHEMBL7682951 0.76 CSNK1A1 (0.61) CSNK1A1CSNK1DCLK2CSNK1G1CDC7

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-2013096637-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 WO disclosed