SCHEMBL11267207

SCHEMBL11267207

CCCCCN(CCC)[C@H]1CCc2c(OC)cccc2[C@H]1C

nearest known ligand 0.88

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.88
DRD3 P35462 6/20 0.88
DRD4 P21917 5/20 0.88
HTR1A P08908 4/20 0.88
MEN1 O00255 2/20 0.88
CYP1A2 P05177 2/20 0.88
HTR5A P47898 2/20 0.88
KMT2A Q03164 2/20 0.88
TSHR P16473 1/20 0.88
CYP2D6 P10635 1/20 0.53
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 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
SCHEMBL11267208 1.00 DRD2 (0.88) DRD2DRD3DRD4HTR1AMEN1
Hydrochloric Acid SCHEMBL9307503 0.99 DRD2 (0.86) DRD2DRD3DRD4HTR1AMEN1
Hydrochloric Acid SCHEMBL9307498 0.99 DRD2 (0.86) DRD2DRD3DRD4HTR1AMEN1
SCHEMBL29766823 0.94 DRD2 (1.00) DRD2DRD3DRD4HTR1AMEN1
SCHEMBL29389256 0.94 DRD2 (1.00) DRD2DRD3DRD4HTR1AMEN1
SCHEMBL273985 0.94 DRD2 (1.00) DRD2DRD3DRD4HTR1AMEN1
Hydrochloric Acid SCHEMBL9306802 0.93 DRD2 (0.97) DRD2DRD3DRD4HTR1AMEN1
Hydrochloric Acid SCHEMBL9358749 0.93 DRD2 (0.97) DRD2DRD3DRD4HTR1AMEN1
Hydrochloric Acid SCHEMBL9309640 0.93 DRD2 (0.97) DRD2DRD3DRD4HTR1AMEN1
SCHEMBL9559065 0.86 DRD2 (0.84) DRD2DRD3DRD4HTR1AMEN1

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
EP-0064964-A1 Therapeutically useful 1-alkyl-2-aminotetralin derivatives Astra Läkemedel Aktiebolag (SE) 1982-11-17 EP disclosed