SCHEMBL8325286

SCHEMBL8325286

COCc1ccc(N2CCN(C)CC2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGXT P21549 1/20 0.44
HTR3A P46098 1/20 0.44
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 4/20 0.43
GAA P10253 3/20 0.43
MAPK1 P28482 2/20 0.43
HTT P42858 2/20 0.43
PTK2B Q14289 2/20 0.43
RAB9A P51151 2/20 0.43
RECQL P46063 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
GLA P06280 1/20 0.42
SIRT6 Q8N6T7 1/20 0.42
ADRA2C P18825 2/20 0.41
HTR6 P50406 1/20 0.41
TP53BP1 Q12888 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL8325282 0.87 MAPT (0.46) MAPTSMN1; SMN2MAPK1HTTRAB9A
SCHEMBL20884918 0.83 KDM4E (0.51) HTR3AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL23917111 0.82 SIRT6 (0.55) AGXTHTR3AMAPTSMN1; SMN2KDM4E
SCHEMBL11245265 0.81 DRD4 (0.57) HTR3AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL30602337 0.79 AGXT (0.44) AGXTHTR3AMAPTSMN1; SMN2KDM4E
SCHEMBL22652120 0.79 GAA (0.58) AGXTHTR3AMAPTSMN1; SMN2KDM4E
SCHEMBL423400 0.77 MAPT (0.65) HTR3AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL8318825 0.75 MAPT (0.59) HTR3AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL31204287 0.74 DRD4 (0.48) HTR3AMAPTSMN1; SMN2KDM4EMAPK1
SCHEMBL22634679 0.73 SIRT6 (0.66) MAPTMAPK1SIRT6HTR6L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5945421-A TREATING PSYCHOSIS AND SCHIZOPHRENIA WARNER-LAMBERT COMPANY (US) 1999-08-31 US disclosed