SCHEMBL7081846

SCHEMBL7081846

Nc1ccc2c(c1)C(=C(Nc1ccc(C(=O)O)cc1)c1ccccc1)C(=O)N2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 4/20 0.46
PIM1 P11309 2/20 0.44
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
AKT2 P31751 3/20 0.40
AKT1 P31749 1/20 0.40
FFAR1 O14842 1/20 0.39
GSK3B P49841 3/20 0.39
TLK2 Q86UE8 2/20 0.39
JAK3 P52333 1/20 0.39
ALDH1A1 P00352 1/20 0.38
BACE1 P56817 1/20 0.38
BRD4 O60885 1/20 0.38
BRD2 P25440 1/20 0.38
RPS6KA3 P51812 1/20 0.37

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
SCHEMBL7081841 1.00 PDPK1 (0.46) PDPK1PIM1MEN1KMT2AAKT2
SCHEMBL7082906 0.93 PDPK1 (0.47) PDPK1MEN1KMT2AAKT2AKT1
SCHEMBL7082903 0.93 PDPK1 (0.47) PDPK1MEN1KMT2AAKT2AKT1
SCHEMBL7086761 0.92 PDPK1 (0.45) PDPK1AKT2AKT1GSK3BTLK2
SCHEMBL7086762 0.92 PDPK1 (0.45) PDPK1AKT2AKT1GSK3BTLK2
SCHEMBL29643001 0.92 PDPK1 (0.45) PDPK1AKT2AKT1GSK3BTLK2
SCHEMBL7087542 0.90 PDPK1 (0.46) PDPK1KMT2AAKT2AKT1GSK3B
SCHEMBL7084766 0.90 PDPK1 (0.48) PDPK1MEN1KMT2AAKT2AKT1
SCHEMBL7084763 0.90 PDPK1 (0.48) PDPK1MEN1KMT2AAKT2AKT1
SCHEMBL7087545 0.90 PDPK1 (0.46) PDPK1KMT2AAKT2AKT1GSK3B

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
EP-1071665-B1 SUBSTITUTED INDOLINONES HAVING AN INHIBITING EFFECT ON KINASES AND CYCLINE/CDK COMPLEXES BOEHRINGER INGELHEIM PHARMA (DE) 2003-10-01 EP disclosed