SCHEMBL7368569

SCHEMBL7368569

COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc3cc(C(=O)OC(C)(C)C)[nH]c3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.55
NPC1 O15118 7/20 0.53
RAB9A P51151 6/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
POLB P06746 1/20 0.53
NR1H4 Q96RI1 2/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
PPARD Q03181 1/20 0.52
PKM P14618 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PPARG P37231 1/20 0.50
PPARA Q07869 1/20 0.50
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
F10 P00742 4/20 0.47
COMT P21964 1/20 0.46

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
SCHEMBL7370555 0.91 NR1H4 (0.59) RXFP1NR1H4PPARDPPARGPPARA
SCHEMBL7365818 0.81 SCN3A (0.46) RXFP1NPC1RAB9A
SCHEMBL7368426 0.80 NPC1 (0.54) RXFP1NPC1RAB9AMEN1KMT2A
SCHEMBL7367092 0.80 NR1H4 (0.46) NR1H4PPARDPPARGPPARAF10
SCHEMBL6172966 0.79 NR1H4 (0.46) MEN1KMT2ANR1H4PPARDPPARG
SCHEMBL6169797 0.79 NPC1 (0.61) RXFP1NPC1RAB9AMEN1KMT2A
SCHEMBL7366501 0.78 F10 (0.47) NR1H4PPARDPPARGPPARAF10
SCHEMBL7367665 0.78 RAB9A (0.48) RXFP1NPC1RAB9AMEN1KMT2A
SCHEMBL6172523 0.78 RXFP1 (0.55) RXFP1NPC1RAB9AMEN1KMT2A
SCHEMBL7369726 0.77 HTT (0.53) NPC1RAB9AMEN1KMT2APOLB

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-1019045-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-03 EP disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A9 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 1999-08-05 WO disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed