SCHEMBL8946151

SCHEMBL8946151

Cc1cc2cc(OCc3ccccc3)ccc2n1N(CCO)c1ccncc1F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
BCHE P06276 3/20 0.43
SRD5A2 P31213 1/20 0.40
LTB4R Q15722 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
SLC6A2 P23975 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
ROCK1 Q13464 1/20 0.36
HSP90AA1 P07900 1/20 0.36
ALOX5 P09917 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 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
SCHEMBL8946223 0.85 MEN1 (0.44) MEN1KMT2ANPC1RAB9ABCHE
SCHEMBL8946048 0.84 BCHE (0.44) MEN1KMT2ANPC1RAB9ABCHE
SCHEMBL7621050 0.76 BCHE (0.51) MEN1KMT2ANPC1RAB9ABCHE
Hydrochloric Acid SCHEMBL8544417 0.76 BCHE (0.51) MEN1KMT2ANPC1RAB9ABCHE
SCHEMBL8946193 0.74 BCHE (0.46) MEN1KMT2ABCHESRD5A2ROCK1
SCHEMBL7620277 0.73 BCHE (0.71) MEN1KMT2ANPC1RAB9ABCHE
SCHEMBL8946189 0.73 ROCK1 (0.43) MEN1KMT2ANPC1RAB9ASRD5A2
SCHEMBL8946215 0.69 SLC6A2 (0.56) BCHESLC6A2ROCK1
SCHEMBL9674458 0.67 ROCK1 (0.46) MEN1KMT2ANPC1RAB9ASRD5A2
SCHEMBL8946156 0.67 SLC6A2 (0.49) MEN1KMT2ABCHESLC6A2

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