SCHEMBL9024447

SCHEMBL9024447

N[C@@H]1CCc2ccccc2NC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.52
SMYD3 Q9H7B4 1/20 0.42
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ANPEP P15144 4/20 0.38
NPC1 O15118 1/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 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
SCHEMBL4703041 1.00 PLAU (0.52) PLAUSMYD3ALOX15HSD17B10MEN1
SCHEMBL29350964 1.00 PLAU (0.52) PLAUSMYD3ALOX15HSD17B10MEN1
SCHEMBL9691688 0.89 MAPT (0.41) PLAUSMYD3ALOX15HSD17B10MEN1
Fumaric Acid SCHEMBL11638981 0.86 SMYD3 (0.43) PLAUSMYD3GAAMAPT
Fumaric Acid SCHEMBL11638993 0.86 SMYD3 (0.43) PLAUSMYD3GAAMAPT
SCHEMBL30576492 0.80 PLAU (0.45) PLAUALOX15HSD17B10MEN1KMT2A
SCHEMBL2030277 0.80 PLAU (0.45) PLAUALOX15HSD17B10MEN1KMT2A
SCHEMBL3825586 0.80 PLAU (0.45) PLAUALOX15HSD17B10MEN1KMT2A
SCHEMBL8567210 0.80 PLAU (0.45) PLAUALOX15HSD17B10MEN1KMT2A
Indoline SCHEMBL2111659 0.78 PLAU (0.44) PLAUSMYD3ALOX15HSD17B10MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0513974-B1 Novel benzo-fused lactams that promote the release of growth hormone MERCK & CO INC (US) 1996-09-04 EP disclosed
EP-0665748-A4 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE. 1995-08-23 EP disclosed
EP-0665748-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1995-08-09 EP disclosed
EP-0513974-A1 Novel benzo-fused lactams that promote the release of growth hormone MERCK & CO. INC. (US) 1992-11-19 EP disclosed