SCHEMBL6016059

SCHEMBL6016059

Cc1[c]n(CCN2CCOCC2)cn1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
HTR2A P28223 1/20 0.40
SCN1A P35498 1/20 0.40
HTR2B P41595 1/20 0.40
KCNH2 Q12809 1/20 0.40
SCN2A Q99250 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
SCN3A Q9NY46 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
SYK P43405 1/20 0.39
LMNA P02545 2/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL16254583 0.71 KDM5A (0.49) MAPK1POLBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL6015760 0.67 PKM (0.36) POLBSMN1; SMN2ALDH1A1SIGMAR1HRH3
SCHEMBL6015852 0.67 SMN1; SMN2 (0.41) MAPK1POLBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL3258076 0.67 LMNA (0.38) MAPK1POLBALDH1A1CYP1A2CHRM2
SCHEMBL235080 0.66 KDM4E (0.65) POLBSMN1; SMN2ALDH1A1SIGMAR1HRH3
SCHEMBL17008888 0.66 SMN1; SMN2 (0.46) MAPK1SMN1; SMN2ALDH1A1CYP1A2CHRM2
SCHEMBL10247439 0.64 HTR2A (0.51) MAPK1POLBALDH1A1CYP1A2CHRM2
SCHEMBL14553277 0.64 ALDH1A1 (0.51) MAPK1POLBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL19732396 0.64 FLT3 (0.49) MAPK1POLBSMN1; SMN2ALDH1A1SIGMAR1
SCHEMBL10913328 0.63 KDM4E (0.70) POLBSMN1; SMN2ALDH1A1SIGMAR1USP2

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