SCHEMBL6026569

SCHEMBL6026569

Oc1ccc2c(ccc3[nH]c4ccncc4c32)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 6/20 0.52
CCND1 P24385 6/20 0.52
CHEK1 O14757 5/20 0.52
KIT P10721 1/20 0.48
PDGFRA P16234 1/20 0.48
FGFR3 P22607 1/20 0.48
ACHE P22303 4/20 0.45
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
KIF11 P52732 1/20 0.41
DAO P14920 1/20 0.41
WEE1 P30291 2/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL635643 0.78 CDK4 (0.71) CDK4CCND1CHEK1KITACHE
SCHEMBL30448628 0.78 KIF11 (0.59) CHEK1KITPDGFRAFGFR3ACHE
SCHEMBL14329664 0.76 ACHE (0.49) CDK4CCND1CHEK1ACHEKIF11
SCHEMBL14126239 0.73 CDK4 (0.47) CDK4CCND1CHEK1KITPDGFRA
SCHEMBL29723882 0.71 CHUK (0.65) CHEK1KITPDGFRAFGFR3ACHE
SCHEMBL3191588 0.71 CHUK (0.65) CHEK1KITPDGFRAFGFR3ACHE
SCHEMBL11071687 0.70 HASPIN (0.48) CHEK1KITPDGFRAFGFR3ACHE
SCHEMBL4822655 0.69 KIF11 (0.58) CHEK1KIF11
SCHEMBL8120408 0.69 CDK4 (1.00) CDK4CCND1CHEK1KITACHE
SCHEMBL29848541 0.69 CDK4 (1.00) CDK4CCND1CHEK1KITACHE

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
EP-1663219-A2 USE OF INDOLE-DERIVED COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT THAT CAN BE USED TO TREAT DISEASES RELATED TO THE SPLICING PROCESS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2006-06-07 EP disclosed
WO-2005023255-A2 USE OF INDOLE-DERIVED COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT THAT CAN BE USED TO TREAT DISEASES RELATED TO THE SPLICING PROCESS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2005-03-17 WO disclosed