SCHEMBL7046375

SCHEMBL7046375

CCC1(CC)CCCN(Cc2ccccc2)C1=O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.68
MEN1 O00255 1/20 0.68
HCRTR1 O43613 5/20 0.49
HCRTR2 O43614 5/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ELANE P08246 2/20 0.47
DDB1 Q16531 1/20 0.45
CRBN Q96SW2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
OPRM1 P35372 1/20 0.42
OPRL1 P41146 1/20 0.42
RIPK1 Q13546 1/20 0.42
CYP2C19 P33261 3/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL6733910 0.93 KMT2A (0.62) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL6734594 0.84 KMT2A (0.66) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL6733707 0.84 KMT2A (0.54) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL9726979 0.81 KMT2A (1.00) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL6732939 0.80 MEN1 (0.43) KMT2AMEN1HCRTR1HCRTR2
SCHEMBL5093540 0.80 KMT2A (0.73) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL7954875 0.79 KMT2A (0.59) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL7954267 0.78 KMT2A (0.54) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL6732110 0.78 KMT2A (0.66) KMT2AMEN1HCRTR1HCRTR2L3MBTL1
SCHEMBL19585933 0.77 KMT2A (0.57) KMT2AMEN1HCRTR1HCRTR2L3MBTL1

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
WO-2003007940-A1 LACTAM AND THIOLACTAM DERIVATIVES AS ANESTHETIC AND CONSCIOUS SEDATION AGENTS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2003-01-30 WO disclosed
US-6066666-A OPTIONALLY N-SUBSTITUTED 3-MONO- AND DI-SUBSTITUTED 2-PYRROLIDINONES AND THIOLACTAM ANALOGS; TREAT SEIZURES, ANXIETY, AND ENHANCING 4-AMINOBUTYRIC ACID (GABA)-INDUCED CHLORIDE CURRENTS AT GABA RECEPTOR/IONOPHORE COMPLEX WASHINGTON UNIVERSITY (US) 2000-05-23 US disclosed
US-5776959-A Anticonvulsant and anxiolytic lactam and thiolactam derivatives WASHINGTON UNIVERSITY (US) 1998-07-07 US disclosed