SCHEMBL8368757

SCHEMBL8368757

O=C1c2cc3c(cc2OCN1CCO)C(=O)N(CCO)CO3

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
GRIA1 P42261 1/20 0.32
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
HEXA P06865 1/20 0.31
HEXB P07686 1/20 0.31
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 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
SCHEMBL8980596 0.89 IMPDH2 (0.37) KDM4E
SCHEMBL8641729 0.84 MAOA (0.45) KDM4E
SCHEMBL8636633 0.84 MAPT (0.41) KDM4E
SCHEMBL8640110 0.83 ALDH1A1 (0.40) KDM4EPARP1PARP2TSHRHTT
SCHEMBL8980735 0.83 DPP4 (0.39) KDM4E
SCHEMBL9174068 0.83 MEN1 (0.43) KDM4ETSHRHTT
SCHEMBL8980606 0.83 FABP6 (0.41) KDM4EHSD17B10
SCHEMBL8573189 0.83 MAOB (0.40) USP2HTT
SCHEMBL8980601 0.83 APP (0.39)
SCHEMBL8575685 0.83 CYP19A1 (0.39) KDM4ETSHRHTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799913-B2 Carbonylbenzoxazine compounds for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2010-09-21 US disclosed
US-7799913-B2 Carbonylbenzoxazine compounds for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2010-09-21 US disclosed
WO-2003045315-A2 CARBONYLBENZOXAZINE COMPOUNDS FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES CORTEX PHARMACEUTICALS, INC. (US) 2003-06-05 WO disclosed