SCHEMBL7477425

SCHEMBL7477425

CN(C)C(=O)Oc1ccc2c(c1)CN(Nc1ccncc1)CC2

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.46
BCHE P06276 1/20 0.39
RAB9A P51151 1/20 0.38
LIPE Q05469 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NCEH1 Q6PIU2 1/20 0.36

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
SCHEMBL7484036 0.96 ACHE (0.43) ACHEBCHERAB9ALIPENPSR1
SCHEMBL7479310 0.89 ACHE (0.43) ACHEBCHERAB9ANPSR1
Hydrochloric Acid SCHEMBL7479308 0.89 ACHE (0.43) ACHEBCHERAB9A
SCHEMBL7477389 0.84 KMT2A (0.53) ACHEBCHENPSR1MEN1KMT2A
SCHEMBL7475137 0.84 KMT2A (0.53) ACHEBCHENPSR1MEN1KMT2A
SCHEMBL7484532 0.83 KMT2A (0.42) ACHEBCHELIPENPSR1MEN1
SCHEMBL7485133 0.81 DRD1 (0.48) LIPE
SCHEMBL7477430 0.80 MEN1 (0.38) RAB9ALIPEMEN1KMT2A
SCHEMBL7480200 0.80 ACHE (0.41) ACHEBCHELIPE
SCHEMBL7489390 0.79 LIPE (0.61) BCHERAB9ALIPE

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-0950056-B1 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP claimed
EP-0950056-A2 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS HOECHST MARION ROUSSEL, INC. (US) 1999-10-20 EP claimed
WO-1998029407-A2 N-(PYRIDINYLAMINO)ISOINDOLINES FOR TREATING ALZHEIMER'S AND DEPRESSION HOECHST MARION ROUSSEL, INC. (US) 1998-07-09 WO claimed
EP-0950056-B1 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP disclosed
US-6004977-A ANTIDEPRESSANTS, COGNITION ACTIVATORS, AND ALZHEIMER'S DISEASE TREATMENT HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
EP-0950056-A2 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS HOECHST MARION ROUSSEL, INC. (US) 1999-10-20 EP disclosed
WO-1998029407-A2 N-(PYRIDINYLAMINO)ISOINDOLINES FOR TREATING ALZHEIMER'S AND DEPRESSION HOECHST MARION ROUSSEL, INC. (US) 1998-07-09 WO disclosed