SCHEMBL8558008

SCHEMBL8558008

CC(=O)c1ccc(CCCCCCc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.69
HSD17B10 Q99714 1/20 0.68
HDAC1 Q13547 3/20 0.64
MAPT P10636 3/20 0.58
RXFP1 Q9HBX9 1/20 0.58
KMT2A Q03164 3/20 0.57
HDAC8 Q9BY41 2/20 0.56
MAOB P27338 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
RARB P10826 4/20 0.53
ALDH1A1 P00352 2/20 0.53
DPP4 P27487 1/20 0.53
MEN1 O00255 1/20 0.53
RARA P10276 1/20 0.53
MTOR P42345 1/20 0.53
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
HDAC4 P56524 1/20 0.52
SLC6A3 Q01959 1/20 0.52

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
SCHEMBL8561241 0.98 LMNA (0.71) LMNAHSD17B10HDAC1MAPTRXFP1
SCHEMBL8559273 0.94 LMNA (0.71) LMNAHSD17B10HDAC1MAPTRXFP1
SCHEMBL2354530 0.90 LMNA (0.77) LMNAHSD17B10HDAC1MAPTKMT2A
SCHEMBL17457887 0.90 HSD17B10 (0.74) LMNAHSD17B10MAPTKMT2ARARB
SCHEMBL11424105 0.86 HSD17B10 (0.74) LMNAHSD17B10MAPTKMT2AHDAC8
SCHEMBL22017525 0.85 GAA (0.68) LMNAHSD17B10MAPTKMT2AMAOB
SCHEMBL25175631 0.85 HSD17B10 (0.86) LMNAHSD17B10HDAC1MAPTRXFP1
SCHEMBL19784149 0.85 HSD17B10 (0.86) LMNAHSD17B10HDAC1MAPTRXFP1
SCHEMBL499485 0.85 THRA (0.70) HSD17B10MAPTKMT2ARARBALDH1A1
SCHEMBL8383207 0.85 THRA (0.70) HSD17B10MAPTKMT2ARARBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5843997-A Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 1998-12-01 US disclosed
US-5576323-A CENTRAL NERVOUS SYSTEM DISORDERS ELI LILLY AND COMPANY (US) 1996-11-19 US disclosed
EP-0658539-A1 Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 1995-06-21 EP disclosed