SCHEMBL8957751

SCHEMBL8957751

CCC(N)N1CCN(c2ccccc2OC)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.58
DRD3 P35462 3/20 0.58
POLB P06746 1/20 0.55
HTR1A P08908 3/20 0.55
LMNA P02545 4/20 0.54
ALDH1A1 P00352 2/20 0.54
PKM P14618 1/20 0.53
HTR6 P50406 2/20 0.53
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
ADRB1 P08588 1/20 0.53
CYP2C19 P33261 1/20 0.53
HTR3A P46098 1/20 0.53
HTR3D Q70Z44 1/20 0.53
HTR3C Q8WXA8 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
HTR7 P34969 1/20 0.52
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
HTT P42858 2/20 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
SCHEMBL30724862 0.90 DRD2 (0.61) DRD2DRD3POLBHTR1ALMNA
SCHEMBL5498735 0.90 DRD2 (0.61) DRD2DRD3POLBHTR1ALMNA
SCHEMBL6193262 0.86 ADRA1A (0.55) HTR1AADRA1DADRA1AADRA1B
SCHEMBL9527919 0.85 HTR1A (0.62) DRD2DRD3POLBHTR1ALMNA
SCHEMBL13648743 0.85 POLB (0.65) DRD2DRD3POLBHTR1ALMNA
SCHEMBL7671076 0.83 DRD2 (0.63) DRD2DRD3POLBHTR1ALMNA
SCHEMBL10746398 0.82 DRD2 (0.58) DRD2DRD3POLBHTR1ALMNA
SCHEMBL6509662 0.82 DRD2 (0.58) DRD2DRD3POLBHTR1ALMNA
SCHEMBL6506614 0.82 DRD2 (0.58) DRD2DRD3POLBHTR1ALMNA
SCHEMBL8828444 0.82 DRD2 (0.58) DRD2DRD3POLBHTR1ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5503843-A PATCH HAVING EITHER A LIQUID RESERVOIR OR MONOLITHIC MATRIX CONTAINING A PERMEATION ENHANCER AND 2-PHENYL-3-METHYL-8-(1-(4-(METHOXYPHENYL)PIPERAZIN-1-YL)PROPYLAMINO-4 -CARBONYL-4H-CHROMEN-4-ONE; BENIGN PROSTRATE HYPERPLASIA FLORA INC. (US) 1996-04-02 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
EP-0372305-B1 PIPERAZINYLALKYL-3(2H)-PYRIDAZINONES, METHOD FOR THEIR PREPARATION AND THEIR USE AS ANTIHYPERTENSIVE AGENTS Hafslund Nycomed Pharma Aktiengesellschaft (AT) 1993-08-04 EP disclosed
US-5106849-A Treating anxiety, depression, psychoses AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-21 US disclosed
US-5034391-A Piperazinylalkyl-3(2H)-pyridazinones and the use thereof as agents lowering blood pressure CL PHARMA AKTIENGESELLSCHAFT (AT) 1991-07-23 US disclosed
US-5010078-A Anxiolytic, antidepressant agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-04-23 US disclosed
EP-0372305-A1 Piperazinylalkyl-3(2H)-pyridazinones, method for their preparation and their use as antihypertensive agents Hafslund Nycomed Pharma Aktiengesellschaft (AT) 1990-06-13 EP disclosed
EP-0343961-A2 Aryl- and heteroaryl piperazinyl carboxamides having central nervous system activity AMERICAN HOME PRODUCTS CORPORATION (US) 1989-11-29 EP disclosed