SCHEMBL28101192

SCHEMBL28101192

CCn1cc(C2=C(c3c[nH]c4cc(F)ccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 13/20 0.76
PRKACG P22612 13/20 0.76
PRKACB P22694 13/20 0.76
CDK4 P11802 7/20 0.76
CCND1 P24385 7/20 0.76
CCNE2 O96020 4/20 0.76
CCNE1 P24864 4/20 0.76
CDK2 P24941 4/20 0.76
CAMK2D Q13557 5/20 0.58
CCNB2 O95067 3/20 0.57
CDK1 P06493 3/20 0.57
CCNB1 P14635 3/20 0.57
CCNB3 Q8WWL7 3/20 0.57
SIRT2 Q8IXJ6 2/20 0.57
GSK3B P49841 2/20 0.57
MEN1 O00255 1/20 0.57
PRKD3 O94806 1/20 0.57
TP53 P04637 1/20 0.57
PRKCG P05129 1/20 0.57
CYP1A2 P05177 1/20 0.57

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
SCHEMBL27789768 0.88 PRKACA (0.74) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101203 0.88 IDH1 (0.60) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20624143 0.88 CDK4 (0.76) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28682000 0.86 PRKACA (0.56) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20624187 0.83 PRKACA (0.55) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20624149 0.82 PRKACA (0.54) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101312 0.81 SIRT2 (0.54) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101295 0.81 CAMK2D (0.76) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087145 0.81 PRKCB (0.74) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL9087563 0.80 PRKACA (0.71) PRKACAPRKACGPRKACBCDK4CCND1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110218206-B Bisindolylmaleimide derivative and preparation method and application thereof 中国海洋大学 2022-03-04 CN disclosed
CN-110526903-B Bisindolylmaleimide derivative and preparation method and application thereof 中国海洋大学 2021-12-10 CN disclosed
CN-106146475-A Bisindolylmaleimide derivative and preparation method and application thereof 中国海洋大学 2016-11-23 CN disclosed
CN-106083830-A Bisindolylmaleimide derivative and preparation method and application thereof 中国海洋大学 2016-11-09 CN disclosed