SCHEMBL6015705

SCHEMBL6015705

OCCOCn1c[c]c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
UPP1 Q16831 1/20 0.38
ALDH1A1 P00352 2/20 0.32
RECQL P46063 2/20 0.32
CCNB2 O95067 4/20 0.31
CDK1 P06493 4/20 0.31
CCNB1 P14635 4/20 0.31
CCNB3 Q8WWL7 4/20 0.31
APAF1 O14727 1/20 0.31
RAD52 P43351 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
USP2 O75604 1/20 0.30
PNP P00491 1/20 0.30
TSHR P16473 1/20 0.30
EDNRA P25101 1/20 0.30
HTR2A P28223 1/20 0.30
BLM P54132 1/20 0.30
HBB P68871 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6229906 0.77 TSHR (0.44) ALDH1A1TSHR
SCHEMBL9581979 0.77
SCHEMBL2948314 0.76 KDM4E (0.38) ALDH1A1TSHRHSD17B10
SCHEMBL6015686 0.76 USP2 (0.35) UPP1RECQLUSP2PNPTSHR
SCHEMBL7093719 0.75 CNR1 (0.38)
SCHEMBL2946816 0.73 CNR2 (0.39)
SCHEMBL6229846 0.73 ALDH1A1 (0.39) ALDH1A1NPSR1HSD17B10
SCHEMBL3865988 0.70 TDP1 (0.31)
SCHEMBL5497340 0.70 ALDH1A1 (0.34) MEN1KMT2AALDH1A1NPSR1HBB
SCHEMBL17956195 0.69 LTA4H (0.42) MEN1KMT2ATSHR

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