SCHEMBL1109657

SCHEMBL1109657

NC(=O)CN1CCNCC1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.41
DPP4 P27487 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
HTR2C P28335 2/20 0.39
OPRD1 P41143 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA4 P22748 2/20 0.39
CA9 Q16790 2/20 0.39
HTR2A P28223 1/20 0.38
HTR2B P41595 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
TACR1 P25103 2/20 0.38
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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 SCHEMBL7293029 0.99 SIGMAR1 (0.40) SIGMAR1DPP4DPP7HTR2COPRD1
SCHEMBL6301700 0.88 SIGMAR1 (0.42) SIGMAR1DPP4DPP7HTR2CHTR2A
SCHEMBL2885089 0.85 SIGMAR1 (0.41) SIGMAR1DPP4DPP7HTR2CCA1
SCHEMBL10772014 0.85 ALDH1A1 (0.50) SIGMAR1DPP4DPP7HTR2CHTR2A
SCHEMBL27843488 0.81 SLC6A2 (0.41) SIGMAR1HTR2CHTR2AHTR2BCYP2D6
Hydrochloric Acid SCHEMBL28338297 0.81 MAPT (0.41) OPRD1TACR1
SCHEMBL27760304 0.80 OPRM1 (0.40) HTR2COPRD1HTR2AHTR2BTACR1
SCHEMBL6190053 0.80 SIGMAR1 (0.43) SIGMAR1ALDH1A1HSD17B10RIPK1
SCHEMBL16908331 0.79 CA1 (0.55) DPP4DPP7CA1CA2CA4
SCHEMBL1923622 0.79 HTR2C (0.40) DPP4DPP7HTR2CHTR2AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102391169-B The preparation method of N-(5-methoxyl group-3-indolylethyl)-4-substituted phenylpiperazine-1-ethanamide SHANGHAI CHEMICAL REAGENT INST. (CN) 2015-10-28 CN disclosed
US-20150203590-A1 LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 ANTIBODY COMPOSITIONS AND METHODS OF USE DIAZYME LABORATORIES, INC. 2015-07-23 US disclosed
US-9000132-B2 Lipoprotein-associated phospholipase A2 antibody compositions and methods of use DIADEXUS, INC. (US) 2015-04-07 US disclosed
WO-2014144040-A1 LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 ANTIBODY COMPOSITIONS AND METHODS OF USE DIADEXUS, INC. (US) 2014-09-18 WO disclosed
US-20140283157-A1 LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 ANTIBODY COMPOSITIONS AND METHODS OF USE DIADEXUS, INC. (US) 2014-09-18 US disclosed
US-20140275485-A1 LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 ANTIBODY COMPOSITIONS AND METHODS OF USE DIADEXUS, INC. (US) 2014-09-18 US disclosed
US-20130236450-A1 Methods Using Lipoprotein-Associated Phospholipase A2 in an Acute Care Setting MONTANER JOAN (ES) 2013-09-12 US disclosed
EP-1718967-B1 METHODS OF DETECTING Lp-PLA2 ACTIVITY DIADEXUS INC (US) 2013-04-24 EP disclosed
EP-2563914-A1 METHODS USING LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 IN AN ACUTE CARE SETTING Diadexus, Inc. (US) 2013-03-06 EP disclosed
CN-102391169-A Method for preparing N-(5-methoxy-1H-indole-3-ethyl)-4-subtituted phenylpiperazine-1-acetamide SHANGHAI CHEMICAL REAGENT RES INST 2012-03-28 CN disclosed
WO-2011137419-A1 METHODS USING LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 IN AN ACUTE CARE SETTING DIADEXUS, INC. (US) 2011-11-03 WO disclosed
EP-2280282-A1 Methods of detecting Lp-PLA2 activity Diadexus, Inc. (US) 2011-02-02 EP disclosed
EP-1718967-A4 METHODS OF DETECTING Lp-PLA2 ACTIVITY DIADEXUS INC (US) 2008-03-05 EP disclosed
US-20070281323-A1 Methods Of Detecting Lp-PLA2 Activity DIAZYME LABORATORIES, INC. 2007-12-06 US disclosed
EP-1718967-A2 METHODS OF DETECTING Lp-PLA2 ACTIVITY Diadexus, Inc. (US) 2006-11-08 EP disclosed
WO-2005074604-A2 METHODS OF DETECTING Lp-PLA2 ACTIVITY DIADEXUS, INC. (US) 2005-08-18 WO disclosed
US-4567264-A ADRENERGIC BLOCKING AGENTS SYNTEX (U.S.A.) INC. (US) 1986-01-28 US disclosed
US-4558129-A Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade SYNTEX (U.S.A.) INC. (US) 1985-12-10 US disclosed
EP-0126449-A1 Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry SYNTEX (U.S.A.) INC. (US) 1984-11-28 EP disclosed