SCHEMBL8561241

SCHEMBL8561241

CC(=O)c1ccc(CCCCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.71
HSD17B10 Q99714 1/20 0.70
HDAC1 Q13547 5/20 0.61
KMT2A Q03164 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
MAOB P27338 1/20 0.56
MAPT P10636 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
RXFP1 Q9HBX9 1/20 0.55
DPP4 P27487 1/20 0.54
HDAC3 O15379 1/20 0.53
MAPK1 P28482 1/20 0.53
ADRA1A P35348 1/20 0.53
HDAC4 P56524 1/20 0.53
SLC6A3 Q01959 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53

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
SCHEMBL8558008 0.98 LMNA (0.69) LMNAHSD17B10HDAC1KMT2AHDAC8
SCHEMBL8559273 0.96 LMNA (0.71) LMNAHSD17B10HDAC1KMT2AHDAC8
SCHEMBL2354530 0.92 LMNA (0.77) LMNAHSD17B10HDAC1KMT2AHDAC8
SCHEMBL17457887 0.92 HSD17B10 (0.74) LMNAHSD17B10KMT2AMAPTALDH1A1
SCHEMBL11424105 0.87 HSD17B10 (0.74) LMNAHSD17B10KMT2AHDAC8MAPT
SCHEMBL7741913 0.86 MAPT (0.70) LMNAHSD17B10HDAC1KMT2AMAOB
SCHEMBL11727340 0.85 L3MBTL1 (0.72) KMT2AMAOBSMN1; SMN2ALDH1A1NPC1
SCHEMBL2212719 0.85 HSD17B10 (0.89) LMNAHSD17B10HDAC1KMT2AHDAC8
SCHEMBL7825556 0.84 HSD17B10 (0.70) LMNAHSD17B10KMT2AHDAC8MAPT
SCHEMBL9258997 0.84 HSD17B10 (0.65) LMNAHSD17B10KMT2AMAPTALDH1A1

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