SCHEMBL6015760

SCHEMBL6015760

CCN(CC)CCn1[c]c(C)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.36
POLB P06746 2/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
RAD52 P43351 1/20 0.31
RAB9A P51151 1/20 0.31
SMARCA2 P51531 1/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SIGMAR1 Q99720 2/20 0.31
USP2 O75604 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
KAT2B Q92831 1/20 0.31
HRH4 Q9H3N8 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
RCE1 Q9Y256 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
SCHEMBL18516702 0.68 ALPL (0.39) PKMPOLBKDM4EHRH4HRH3
SCHEMBL6016059 0.67 MAPK1 (0.40) POLBSMN1; SMN2ALDH1A1SIGMAR1USP2
SCHEMBL6015759 0.66 PKM (0.36) PKMPOLBSMN1; SMN2NPC1GAA
SCHEMBL6015676 0.64 PKM (0.37) PKMPOLBKDM4ESMN1; SMN2NPC1
SCHEMBL349048 0.64
SCHEMBL11144216 0.63 KMT2A (0.59) PKMPOLBALDH1A1TLR7
SCHEMBL6015710 0.62 POLB (0.38) PKMPOLBKDM4ESMN1; SMN2NPC1
SCHEMBL14310912 0.59 PKM (0.36) PKMPOLBNPC1GAARAD52
SCHEMBL306453 0.59 POLB (0.33) PKMPOLBKDM4ESMN1; SMN2NPC1
SCHEMBL5983039 0.59 PKM (0.33) PKMPOLBSMN1; SMN2NPC1GAA

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