SCHEMBL6015934

SCHEMBL6015934

CC(CNC(=O)c1cccc2[c]c[nH]c12)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLR1A O95602 1/20 0.40
POLB P06746 1/20 0.37
HDAC4 P56524 3/20 0.36
HDAC6 Q9UBN7 3/20 0.36
HDAC1 Q13547 3/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 3/20 0.35
GAA P10253 2/20 0.35
HSD17B10 Q99714 1/20 0.35
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
MEN1 O00255 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
HDAC2 Q92769 2/20 0.33
MAPK1 P28482 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC10 Q969S8 1/20 0.33

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
SCHEMBL9581656 0.80 L3MBTL1 (0.40) HDAC4HDAC6HDAC1KMT2AADRA1D
SCHEMBL6016001 0.78 KDM4E (0.46) POLBHDAC4HDAC6HDAC1KMT2A
SCHEMBL6015846 0.75 MAPK1 (0.50) POLBKMT2AGAAHSD17B10MEN1
SCHEMBL9581327 0.75 PLK1 (0.45) POLBHDAC6KMT2AGAAADRA1A
SCHEMBL6016004 0.74 POLB (0.43) POLBHDAC4HDAC6HDAC1NPC1
SCHEMBL8639330 0.73 NAAA (0.50) POLR1APOLBNPC1RAB9AKMT2A
SCHEMBL9581476 0.72 MEN1 (0.41) POLBKMT2AADRA1DADRA1AADRA1B
SCHEMBL6015935 0.69 PIM1 (0.46) POLBKMT2AHSD17B10KDM4EALDH1A1
SCHEMBL6015695 0.68 DRD2 (0.47) POLBKMT2AGAAHSD17B10MAPK1
SCHEMBL6015658 0.68 CYP1A2 (0.47) POLR1APOLBKMT2AHSD17B10MEN1

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
US-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US claimed
EP-1181282-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP claimed
WO-2000075139-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2000-12-14 WO claimed
US-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US disclosed