SCHEMBL6015956

SCHEMBL6015956

Cc1[c]cn(CC(=O)NCCN2CCOCC2)n1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
GAA P10253 1/20 0.52
TSHR P16473 3/20 0.50
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.48
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RXFP1 Q9HBX9 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 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
SCHEMBL6015618 0.89 KMT2A (0.45) POLBL3MBTL1GAATSHRHTT
SCHEMBL6016081 0.81 TSHR (0.52) POLBL3MBTL1GAATSHRKMT2A
SCHEMBL3258076 0.79 LMNA (0.38) POLBGAALMNAKDM4E
SCHEMBL2067169 0.76 SMN1; SMN2 (0.50) POLBL3MBTL1GAATSHRLMNA
SCHEMBL6015745 0.75 KDM4E (0.46) POLBLMNAHTTSMN1; SMN2RXFP1
SCHEMBL23929061 0.74 SMN1; SMN2 (0.82) POLBTSHRHTTKMT2ASMN1; SMN2
SCHEMBL31052729 0.71 GAA (0.57) POLBL3MBTL1GAALMNAKMT2A
SCHEMBL84933 0.70 TSHR (0.59) POLBTSHRKMT2ASMN1; SMN2
SCHEMBL6015718 0.70 MAPK1 (0.55) POLBGAALMNAKMT2ASMN1; SMN2
SCHEMBL6015651 0.69 KDM4E (0.49) POLBKMT2ASMN1; SMN2RXFP1KDM4E

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
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