SCHEMBL6015634

SCHEMBL6015634

CN1CCN(CC(=O)c2c[nH]c3[c]cccc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.49
ALDH1A1 P00352 7/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTT P42858 1/20 0.45
ALOX15 P16050 1/20 0.44
GRIN2B Q13224 1/20 0.42
RECQL P46063 1/20 0.41
LMNA P02545 1/20 0.41
RGS12 O14924 1/20 0.41
CNR2 P34972 1/20 0.40
USP2 O75604 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL6015749 0.95 KMT2A (0.51) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL6015923 0.89 KMT2A (0.62) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL6016069 0.88 KMT2A (0.64) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL6015996 0.85 ALDH1A1 (0.50) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL6015685 0.77 HTR6 (0.63) ALDH1A1HTTLMNAMAPK1
SCHEMBL6015793 0.74 KMT2A (0.46) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL6015920 0.74 ALDH1A1 (0.39) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL6015714 0.72 HTR6 (0.58) KMT2AALDH1A1MEN1HTTLMNA
SCHEMBL6015750 0.72 ALDH1A1 (0.52) KMT2AALDH1A1MAPTMEN1SMN1; SMN2
SCHEMBL3871239 0.70 ATM (0.54) KMT2AALDH1A1MAPTALOX15MAPK1

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