SCHEMBL10741002

SCHEMBL10741002

C1=C(c2ccccc2)CCN(CC2CCc3[nH]c4ccccc4c3C2)C1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.58
DRD3 P35462 3/20 0.58
DRD4 P21917 2/20 0.58
DRD1 P21728 1/20 0.47
DRD5 P21918 1/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
NR2E1 Q9Y466 1/20 0.46

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
SCHEMBL10742755 0.93 DRD2 (0.49) DRD2DRD3DRD4DRD1DRD5
SCHEMBL10745251 0.91 DRD2 (0.48) DRD2DRD3DRD4DRD1DRD5
SCHEMBL10749274 0.89 DRD2 (0.48) DRD2DRD3DRD4KDM4ELMNA
SCHEMBL10742344 0.89 DRD2 (0.53) DRD2DRD3DRD4KDM4ELMNA
SCHEMBL10743376 0.89 DRD2 (0.53) DRD2DRD3DRD4KDM4ELMNA
SCHEMBL10746245 0.88 DRD2 (0.52) DRD2DRD3DRD4
SCHEMBL10747820 0.88 DRD2 (0.52) DRD2DRD3DRD4
SCHEMBL10740975 0.88 DRD2 (0.57) DRD2DRD3DRD4MAPT
SCHEMBL10745131 0.88 DRD2 (0.54) DRD2DRD3DRD4
SCHEMBL10742594 0.88 DRD2 (0.57) DRD2DRD3DRD4MAPT

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
US-4698351-A Tetrahydrocarbazole derivatives and pharmaceutical compositions MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1987-10-06 US claimed
US-4618614-A Method of treating psychosis using tetrahydrocarbazole derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-21 US claimed
US-4698351-A Tetrahydrocarbazole derivatives and pharmaceutical compositions MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1987-10-06 US disclosed
US-4618614-A Method of treating psychosis using tetrahydrocarbazole derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-21 US disclosed
US-4547576-A Tetrahydrocarbazole derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1985-10-15 US disclosed