SCHEMBL7076084

SCHEMBL7076084

NC(=O)c1ccccc1-c1ccc2c(c1)CC(=O)N2

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 2/20 0.63
CACNG8 Q8WXS5 2/20 0.63
CHEK1 O14757 1/20 0.55
PGR P06401 3/20 0.50
PDE3B Q13370 1/20 0.50
PDE3A Q14432 1/20 0.50
BRD4 O60885 2/20 0.49
CREBBP Q92793 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP11B1 P15538 1/20 0.48
CYP11B2 P19099 1/20 0.48
BCAT2 O15382 1/20 0.47
CRBN Q96SW2 1/20 0.47
TDP2 O95551 2/20 0.47
ALOX5AP P20292 1/20 0.46
FEN1 P39748 1/20 0.46
JAK3 P52333 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.45
AHR P35869 2/20 0.45
PDK2 Q15119 1/20 0.45

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
SCHEMBL29849809 0.82 PDE3B (0.59) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL10712809 0.80 GRIA1 (0.69) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL21517844 0.78 PGR (0.56) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL21517849 0.78 GRIA1 (0.62) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL21483771 0.78 GRIA1 (0.66) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL24884440 0.77 GRIA1 (0.69) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL10714302 0.77 GRIA1 (1.00) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL28639586 0.77 GRIA1 (0.69) GRIA1CACNG8PGRPDE3BPDE3A
SCHEMBL29849951 0.77 CRBN (0.51) GRIA1CACNG8CHEK1BRD4CREBBP
SCHEMBL29899624 0.77 TDP2 (0.72) GRIA1CACNG8PGRPDE3BPDE3A

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-1294688-A2 INDOLINONE DERIVATIVES AS PROTEIN KINASE/PHOSPHATASE INHIBITORS Sugen, Inc. (US) 2003-03-26 EP claimed
WO-2001094312-A2 INDOLINONE DERIVATIVES AS PROTEIN KINASE/PHOSPHATASE INHIBITORS SUGEN, INC. (US) 2001-12-13 WO claimed