SCHEMBL9308579

SCHEMBL9308579

CCCN(CCC)C1CCc2ccc(O)cc2C1C

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.66
DRD3 P35462 6/20 0.56
DRD4 P21917 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HTR1A P08908 2/20 0.56
ADRB2 P07550 1/20 0.56
CYP2D6 P10635 1/20 0.56
CASP1 P29466 1/20 0.56
LMNA P02545 2/20 0.54
MAPT P10636 1/20 0.54
OPRM1 P35372 1/20 0.53
OPRD1 P41143 1/20 0.53
OPRK1 P41145 1/20 0.53
CYP1A2 P05177 1/20 0.51
TSHR P16473 1/20 0.51
HTR5A P47898 1/20 0.51

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
SCHEMBL9308578 1.00 DRD2 (0.66) DRD2DRD3DRD4MEN1KMT2A
Bromide SCHEMBL9310045 0.99 DRD2 (0.64) DRD2DRD3DRD4MEN1KMT2A
Bromide SCHEMBL9310041 0.99 DRD2 (0.64) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL9307668 0.81 DRD2 (0.63) DRD2DRD3DRD4MEN1KMT2A
Hydrochloric Acid SCHEMBL9309091 0.80 DRD2 (0.61) DRD2DRD3DRD4MEN1KMT2A
Hydrochloric Acid SCHEMBL9309093 0.80 DRD2 (0.61) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL9355384 0.80 DRD2 (1.00) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL10896490 0.77 DRD2 (0.54) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL6554222 0.76 DRD2 (0.53) DRD2DRD3DRD4MEN1KMT2A
SCHEMBL6363170 0.76 DRD2 (0.53) DRD2DRD3DRD4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5286747-A 1-alkyl-2-aminotetralin derivatives Carlsson, Per A. E. (SE) 1994-02-15 US claimed
EP-0064964-B1 THERAPEUTICALLY USEFUL 1-ALKYL-2-AMINOTETRALIN DERIVATIVES Astra Läkemedel Aktiebolag (SE) 1984-08-08 EP claimed
EP-0064964-A1 Therapeutically useful 1-alkyl-2-aminotetralin derivatives Astra Läkemedel Aktiebolag (SE) 1982-11-17 EP claimed