SCHEMBL30319787

SCHEMBL30319787

CCCOc1ccc2c(c1)c(C1=C(c3cn(CCCN)c4ccccc34)C(=O)NC1=O)cn2C

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 5/20 0.73
PIM1 P11309 2/20 0.73
GSK3B P49841 3/20 0.61
QPCT Q16769 1/20 0.57
KDR P35968 1/20 0.57
PRKCA P17252 1/20 0.57
PRKACA P17612 1/20 0.57
PRKACG P22612 1/20 0.57
PRKACB P22694 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
SCHEMBL5686031 1.00 CAMK2D (0.73) CAMK2DPIM1GSK3BQPCTKDR
SCHEMBL29438694 0.86 CAMK2D (1.00) CAMK2DPIM1PRKCAPRKACAPRKACG
SCHEMBL1942352 0.86 CAMK2D (1.00) CAMK2DPIM1PRKCAPRKACAPRKACG
Hydrochloric Acid SCHEMBL8162861 0.84 CAMK2D (0.98) CAMK2DPIM1PRKCAPRKACAPRKACG
SCHEMBL5683168 0.82 CAMK2D (0.80) CAMK2DPIM1GSK3BPRKCAPRKACA
SCHEMBL30319835 0.82 CAMK2D (0.80) CAMK2DPIM1GSK3BPRKCAPRKACA
SCHEMBL8161316 0.82 CAMK2D (0.87) CAMK2DPIM1GSK3BPRKCAPRKACA
SCHEMBL8154114 0.81 CAMK2D (0.91) CAMK2DPIM1GSK3BPRKCAPRKACA
Hydrochloric Acid SCHEMBL8160489 0.81 CAMK2D (0.91) CAMK2DPIM1GSK3BPRKCAPRKACA
Acetic Acid SCHEMBL8167124 0.81 CAMK2D (0.89) CAMK2DPIM1GSK3BPRKCAPRKACA

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
CN-115969814-A Novel pharmaceutical formulations containing indirubin and derivatives thereof and methods of making and using the same 法斯瑞斯公司 2023-04-18 CN disclosed