SCHEMBL6977935

SCHEMBL6977935

OCC1CN(c2ccccc2)c2ccccc2O1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASR P41180 4/20 0.50
HTR1A P08908 3/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
GRM2 Q14416 8/20 0.44
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL31343816 0.84 GRM2 (0.48) CASRHTR1AMAOAMAOBGRM2
SCHEMBL9455114 0.84 CASR (0.50) CASRHTR1AGRM2ADRA1DADRA1A
SCHEMBL9529252 0.84 CASR (0.50) CASRHTR1AGRM2ADRA1DADRA1A
Hydrochloric Acid SCHEMBL9455268 0.83 CASR (0.49) CASRHTR1AGRM2
SCHEMBL9532833 0.80 CASR (0.59) CASRHTR1AGRM2ADRA1DADRA1A
Hydrochloric Acid SCHEMBL9455227 0.79 CASR (0.58) CASRHTR1AGRM2ADRA1DADRA1A
SCHEMBL4638737 0.79 GRM2 (0.69) MAOAMAOBGRM2
SCHEMBL1874998 0.79 GRM2 (0.69) MAOAMAOBGRM2
SCHEMBL12635778 0.79 GRM2 (0.69) MAOAMAOBGRM2
SCHEMBL9530044 0.78 ABCB1 (0.49) CASRHTR1AADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140925-B1 (3,4 DIHYDRO-2H-BENZO[1,4] OXAZINYL-METHYL)- 3-(1H-INDOL-3- YL)-ALKYL -AMINES WYETH CORP (US) 2003-04-23 EP disclosed
CN-1335845-A 3,4-dihydro-2H-benzo[1,4] oxazinyl-methyl [3-(1H-indol-3-yl)-alkyl]-amines AMERICAN HOME PROD (US) 2002-02-13 CN disclosed
US-6313114-B1 ANTIDEPRESSANTS AMERICAN HOME PRODUCTS CORP 2001-11-06 US disclosed
EP-1140925-A1 (3,4 DIHYDRO-2H-BENZO[1,4] OXAZINYL-METHYL)- 3-(1H-INDOL-3- YL)-ALKYL -AMINES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 EP disclosed
US-6221863-B1 TREATING DEPRESSION IN A PATIENT AMERICAN HOME PRODUCTS CORP. 2001-04-24 US disclosed
WO-2000040581-A1 3,4-DIHYDRO-2H-BENZO[1,4]OXAZINE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-07-13 WO disclosed
WO-2000040580-A1 3,4-DIHYDRO-2H-BENZO[1,4]OXAZINYL-METHYL[3-(1H-INDOL-3-YL)-ALKYL]-AMINES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-07-13 WO disclosed