SCHEMBL6357014

SCHEMBL6357014

COc1ccccc1N1CCN(CCCNC(=O)c2cc3ccccc3o2)CC1

nearest known ligand 0.94

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 17/20 0.94
DRD2 P14416 14/20 0.94
HTR1A P08908 9/20 0.94
DRD4 P21917 8/20 0.94
HTR2A P28223 7/20 0.94
HTR2C P28335 6/20 0.94
DRD1 P21728 4/20 0.94
ADRA1D P25100 2/20 0.94
ADRA1A P35348 2/20 0.94
ADRA1B P35368 2/20 0.94
HTR2B P41595 2/20 0.94
ADRA2A P08913 1/20 0.69

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
Hydrochloric Acid SCHEMBL9082274 0.99 DRD3 (0.93) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL13094451 0.85 DRD3 (1.00) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL4530290 0.82 DRD3 (1.00) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL4522662 0.81 DRD3 (1.00) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL14761584 0.81 DRD2 (0.94) DRD3DRD2HTR1ADRD4ADRA1D
SCHEMBL14430741 0.81 MMP13 (0.76) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL19358669 0.80 DRD3 (1.00) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL13711946 0.80 DRD3 (1.00) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL19358711 0.80 DRD2 (1.00) DRD3DRD2HTR1ADRD4HTR2A
SCHEMBL9652110 0.80 DRD2 (0.73) DRD3DRD2HTR1ADRD4HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343961-B1 Aryl- and heteroaryl piperazinyl carboxamides having central nervous system activity AMERICAN HOME PROD (US) 1996-01-10 EP claimed
EP-0343961-A2 Aryl- and heteroaryl piperazinyl carboxamides having central nervous system activity AMERICAN HOME PRODUCTS CORPORATION (US) 1989-11-29 EP claimed
US-20050095286-A1 Extended release compositions FABRE KRAMER PHARMACEUTICALS, INC. (US) 2005-05-05 US disclosed
EP-0343961-B1 Aryl- and heteroaryl piperazinyl carboxamides having central nervous system activity AMERICAN HOME PROD (US) 1996-01-10 EP disclosed
US-5482940-A OBESITY, ALCOHOLISM AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-09 US disclosed
US-5380725-A Antipsychotic agents and anxiolytic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1995-01-10 US disclosed
US-5278160-A Treating aggressive behavior AMERICAN HOME PRODUCTS CORPORATION (US) 1994-01-11 US disclosed
US-5254552-A Cognition activators, psychological disorders AMERICAN HOME PRODUCTS CORPORATION (US) 1993-10-19 US disclosed
US-5106849-A Treating anxiety, depression, psychoses AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-21 US disclosed
US-5010078-A Anxiolytic, antidepressant agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-04-23 US disclosed
EP-0343961-A2 Aryl- and heteroaryl piperazinyl carboxamides having central nervous system activity AMERICAN HOME PRODUCTS CORPORATION (US) 1989-11-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050095286-A1 Extended release compositions PDE3A, GIPR, PDE7A DRD3 533/4885DRD2 258/4885HTR1A 22/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.