SCHEMBL7433461

SCHEMBL7433461

COc1cc2ccccc2cc1C(=O)NCCCCN1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.72
DRD3 P35462 13/20 0.72
DRD4 P21917 10/20 0.72
ADRA1A P35348 3/20 0.68
HTR1A P08908 5/20 0.66
ADRA2A P08913 5/20 0.66
DRD1 P21728 2/20 0.66
ADRA1D P25100 2/20 0.66
HTR2A P28223 2/20 0.66
HTR2C P28335 2/20 0.66
ADRA1B P35368 2/20 0.66
HTR2B P41595 2/20 0.66
MEN1 O00255 1/20 0.66
LMNA P02545 1/20 0.66
TP53 P04637 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP3A4 P08684 1/20 0.66
CYP2D6 P10635 1/20 0.66
TSHR P16473 1/20 0.66
NFKB1 P19838 1/20 0.66

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
SCHEMBL9653369 0.82 DRD3 (0.72) DRD2DRD3DRD4ADRA1AHTR1A
SCHEMBL7436346 0.81 DRD2 (1.00) DRD2DRD3DRD4ADRA1AHTR1A
SCHEMBL10908587 0.80 DRD2 (0.83) DRD2DRD3DRD4ADRA1AHTR1A
Bp-897 SCHEMBL2125882 0.80 DRD2 (1.00) DRD2DRD3DRD4ADRA1AHTR1A
Bp-897 SCHEMBL30027453 0.80 DRD2 (1.00) DRD2DRD3DRD4ADRA1AHTR1A
Bp-897 SCHEMBL29382551 0.80 DRD2 (1.00) DRD2DRD3DRD4ADRA1AHTR1A
Hydrochloric Acid SCHEMBL7594688 0.79 DRD2 (0.92) DRD2DRD3DRD4ADRA1AHTR1A
SCHEMBL7561768 0.79 DRD2 (0.94) DRD2DRD3DRD4ADRA1AHTR1A
Hydrochloric Acid SCHEMBL7595382 0.78 DRD2 (0.94) DRD2DRD3DRD4ADRA1AHTR1A
Hydrochloric Acid SCHEMBL7590666 0.78 DRD2 (0.94) DRD2DRD3DRD4ADRA1AHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0779284-B1 Novel 2-naphthamide derivatives and their use in therapy as D3 receptor agonists INST NAT SANTE RECH MED (FR) 2002-07-10 EP claimed
US-5872119-A 2-Naphthamide derivatives and their therapeutic applications Institut National De La Sante et De La Recherche Medicale--INSERM (FR) 1999-02-16 US claimed
EP-0779284-A1 Novel 2-naphthamide derivatives and their use in therapy as D3 receptor agonists INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-06-18 EP claimed
EP-0779284-B1 Novel 2-naphthamide derivatives and their use in therapy as D3 receptor agonists INST NAT SANTE RECH MED (FR) 2002-07-10 EP disclosed
US-5985895-A 2-naphthamide derivatives and their therapeutic applications INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE-INSERM (FR) 1999-11-16 US disclosed
US-5872119-A 2-Naphthamide derivatives and their therapeutic applications Institut National De La Sante et De La Recherche Medicale--INSERM (FR) 1999-02-16 US disclosed
EP-0779284-A1 Novel 2-naphthamide derivatives and their use in therapy as D3 receptor agonists INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-06-18 EP disclosed