SCHEMBL28682000

SCHEMBL28682000

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 9/20 0.56
PRKACG P22612 9/20 0.56
PRKACB P22694 9/20 0.56
CDK4 P11802 6/20 0.56
CCND1 P24385 6/20 0.56
CCNE2 O96020 4/20 0.56
CCNE1 P24864 4/20 0.56
CDK2 P24941 4/20 0.56
RPS6KB1 P23443 1/20 0.48
CCNT1 O60563 4/20 0.47
CDK9 P50750 4/20 0.47
PIM1 P11309 2/20 0.46
HTR6 P50406 1/20 0.44
CCNB2 O95067 3/20 0.44
CDK1 P06493 3/20 0.44
CCNB1 P14635 3/20 0.44
CCNB3 Q8WWL7 3/20 0.44
SIRT2 Q8IXJ6 2/20 0.43
MEN1 O00255 1/20 0.43
PRKD3 O94806 1/20 0.43

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
SCHEMBL28681987 0.89 RPS6KB1 (0.60) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20624145 0.89 CDK4 (0.56) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28660892 0.89 RPS6KB1 (0.48) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101192 0.86 PRKACA (0.76) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28661712 0.86 CCNT1 (0.53) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20624155 0.83 CAMK2D (0.58) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28655141 0.81 PRKACA (0.61) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20624168 0.78 CCNT1 (0.49) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL20623442 0.78 CCNT1 (0.60) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101196 0.77 CDK4 (0.57) 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 2 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