SCHEMBL8946215

SCHEMBL8946215

COc1ccc2c(ccn2N(CCO)c2ccncc2F)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.56
BCHE P06276 3/20 0.44
MAPT P10636 2/20 0.39
CYP11B1 P15538 3/20 0.38
CYP11B2 P19099 3/20 0.38
RPS6KA3 P51812 1/20 0.38
HTR2C P28335 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
ORAI1 Q96D31 1/20 0.35
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35

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
SCHEMBL8946101 0.86 BCHE (0.42) SLC6A2BCHEMAPTCYP11B1CYP11B2
SCHEMBL8946156 0.81 SLC6A2 (0.49) SLC6A2BCHEMAPT
SCHEMBL8539324 0.78 BCHE (0.72) SLC6A2BCHEMAOAMAOB
SCHEMBL8546204 0.78 SLC6A2 (0.50) SLC6A2BCHEMAPT
SCHEMBL8946196 0.78 SLC6A2 (0.42) SLC6A2BCHEMAPTROCK1
Hydrochloric Acid SCHEMBL8539619 0.77 SLC6A2 (0.49) SLC6A2BCHEMAPT
SCHEMBL7621050 0.77 BCHE (0.51) SLC6A2BCHEROCK1
Hydrochloric Acid SCHEMBL8544417 0.76 BCHE (0.51) SLC6A2BCHEROCK1
SCHEMBL9738839 0.76 BCHE (0.75) SLC6A2BCHE
Hydrochloric Acid SCHEMBL9671984 0.75 BCHE (0.74) SLC6A2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0509400-B1 1-(Pyrido[3,4-b]-1,4-oxazinyl-4-yl)-1H-indoles, intermediates and a process for their preparation, and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1996-07-03 EP disclosed
US-5519131-A CYCLIZATION OF HYDROXYALKYLAMINO COMPOUND IN THE PRESENCE OF STRONG BASE SUCH AS SODIUM HYDRIDE OR POTASSIUM TERT-BUTOXIDE HOECHST MARION ROUSSEL INC. (US) 1996-05-21 US disclosed
US-5276156-A Antidepressants, treatment of Alzheimer*s disease HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-01-04 US disclosed
US-5214038-A Cholinesterase inhibitors, antidepressants, cognition activators HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-05-25 US disclosed
EP-0509400-A1 1-(Pyrido[3,4-b]-1,4-oxazinyl-4-yl)-1H-indoles, intermediates and a process for their preparation, and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-10-21 EP disclosed