SCHEMBL7489287

SCHEMBL7489287

Oc1cc2c(cc1F)CCN(Nc1ccncc1)C2

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DRD4 P21917 2/20 0.34
DRD3 P35462 1/20 0.34
CYP17A1 P05093 3/20 0.32
CYP3A4 P08684 3/20 0.32
CYP11B1 P15538 3/20 0.32
CYP11B2 P19099 3/20 0.32
ABCB1 P08183 1/20 0.32
DRD2 P14416 1/20 0.31
DRD1 P21728 1/20 0.31
DRD5 P21918 1/20 0.31
GPR142 Q7Z601 1/20 0.31
CYP19A1 P11511 1/20 0.31
ADRA2B P18089 1/20 0.30
EED O75530 1/20 0.30

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
Bromide SCHEMBL7484876 0.99 CYP17A1 (0.34) MEN1KMT2ADRD4DRD3CYP17A1
SCHEMBL7481508 0.82 MEN1 (0.36) MEN1KMT2ADRD4DRD3CYP17A1
Hydrochloric Acid SCHEMBL7482682 0.81 MEN1 (0.36) MEN1KMT2ADRD4DRD3CYP17A1
SCHEMBL7478486 0.81 KMT2A (0.47) MEN1KMT2ADRD4DRD3CYP3A4
SCHEMBL7476993 0.81 DRD3 (0.52) MEN1KMT2ADRD4DRD3DRD2
Hydrochloric Acid SCHEMBL7474283 0.80 DRD3 (0.51) MEN1KMT2ADRD4DRD3DRD2
SCHEMBL7480264 0.80 DRD1 (0.43) DRD4DRD3CYP11B2DRD2DRD1
SCHEMBL7484532 0.77 KMT2A (0.42) MEN1KMT2ADRD4DRD3
SCHEMBL7484538 0.77 KMT2A (0.39) MEN1KMT2ADRD4DRD3
SCHEMBL7478986 0.75 CYP1A2 (0.30) MEN1KMT2ADRD2

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 4 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
CN-1242012-A N- (pyridylamino) isoindolines and related compounds HOECHST MARION ROUSSEL INC (US) 2000-01-19 CN 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