SCHEMBL8980606

SCHEMBL8980606

O=C1c2cc(F)ccc2OCN1CCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP6 P51161 1/20 0.41
CYP19A1 P11511 2/20 0.38
NOTUM Q6P988 1/20 0.36
NR3C2 P08235 1/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
GAA P10253 2/20 0.35
TRPV1 Q8NER1 1/20 0.35
P2RX7 Q99572 1/20 0.34
DRD2 P14416 1/20 0.34
THRB P10828 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
PARK7 Q99497 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL8636633 0.84 MAPT (0.41) KDM4EALDH1A1DRD2RAB9AKMT2A
SCHEMBL8368757 0.83 KDM4E (0.35) KDM4EHSD17B10
SCHEMBL8640110 0.83 ALDH1A1 (0.40) KDM4EALDH1A1GAAMEN1NPC1
SCHEMBL8980601 0.83 APP (0.39) CYP19A1ALDH1A1PRMT5WDR77MEN1
SCHEMBL9174068 0.83 MEN1 (0.43) CYP19A1KDM4EALDH1A1MEN1CYP1A2
SCHEMBL8573189 0.83 MAOB (0.40) CYP19A1NOTUMALDH1A1PKMTDP2
SCHEMBL8980607 0.81 PARP1 (0.39) ALDH1A1L3MBTL1NPC1PKMRAB9A
SCHEMBL8575144 0.80 MAPT (0.44) CYP19A1KDM4EALDH1A1L3MBTL1GAA
SCHEMBL7249895 0.80 KDM4E (0.40) KDM4EALDH1A1DRD2NPC1PKM
SCHEMBL8654922 0.80 CASP3 (0.40) DRD2PRMT5WDR77HTR2AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711286-A1 BENZOXAZINONES AND BENZOTHIAZINONES ENDOWED WITH THERAPEUTIC ACTIVITY ITALFARMACO S.p.A. (IT) 1996-05-15 EP disclosed
WO-1995004048-A1 BENZOXAZINONES AND BENZOTHIAZINONES ENDOWED WITH THERAPEUTIC ACTIVITY ITALFARMACO S.P.A. (IT) 1995-02-09 WO disclosed