SCHEMBL28655141

SCHEMBL28655141

CCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)N(CCO)C2=O)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 9/20 0.61
PRKACG P22612 9/20 0.61
PRKACB P22694 9/20 0.61
CDK4 P11802 4/20 0.61
CCND1 P24385 4/20 0.61
RPS6KB1 P23443 1/20 0.60
CCNT1 O60563 4/20 0.58
CDK9 P50750 4/20 0.58
PIM1 P11309 2/20 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
CAMK2D Q13557 2/20 0.53
SIRT2 Q8IXJ6 4/20 0.53
SIRT1 Q96EB6 2/20 0.53
CCNE2 O96020 2/20 0.53
CCNE1 P24864 2/20 0.53
CDK2 P24941 2/20 0.53
MEN1 O00255 1/20 0.53

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 0.91 RPS6KB1 (0.60) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL27789766 0.89 RPS6KB1 (0.69) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28661599 0.86 CCNT1 (0.64) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28661715 0.84 RPS6KB1 (0.65) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28669970 0.84 PRKACA (0.67) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101305 0.84 RPS6KB1 (0.59) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101293 0.84 SIRT2 (0.60) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL27789768 0.82 PRKACA (0.74) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28101397 0.82 PRKACA (0.58) PRKACAPRKACGPRKACBCDK4CCND1
SCHEMBL28682000 0.81 PRKACA (0.56) 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