SCHEMBL6015635

SCHEMBL6015635

O=C(NCCN1CCOCC1)c1cccc2[c]c[nH]c12

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL3 P20749 5/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HPGD P15428 2/20 0.54
ALDH1A1 P00352 2/20 0.53
KDM5B Q9UGL1 1/20 0.51
GAA P10253 1/20 0.50
CD274 Q9NZQ7 1/20 0.50

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
SCHEMBL6015719 0.90 POLR1A (0.46) BCL3ALDH1A1
SCHEMBL6015658 0.88 CYP1A2 (0.47) MEN1KMT2AHPGDALDH1A1
SCHEMBL6015695 0.81 DRD2 (0.47) KMT2AALDH1A1GAA
SCHEMBL6015767 0.76 POLB (0.60) HPGDALDH1A1CD274
SCHEMBL31298077 0.75 KMT2A (0.67) BCL3MEN1KMT2AHPGDALDH1A1
SCHEMBL31518356 0.75 KMT2A (0.63) BCL3MEN1KMT2AHPGDALDH1A1
SCHEMBL5795351 0.75 KMT2A (0.63) BCL3MEN1KMT2AHPGDALDH1A1
SCHEMBL28602004 0.75 POLB (0.60) BCL3MEN1KMT2A
SCHEMBL8722300 0.75 MEN1 (0.60) BCL3MEN1KMT2AHPGDALDH1A1
SCHEMBL6015846 0.74 MAPK1 (0.50) MEN1KMT2AHPGDALDH1A1GAA

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