SCHEMBL4932784

SCHEMBL4932784

COc1cccc(N(CCO)CCO)c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 11/20 0.56
MTNR1A P48039 10/20 0.56
ALDH1A1 P00352 1/20 0.49
ALOX15 P16050 1/20 0.47
ESR1 P03372 1/20 0.43
HSD17B2 P37059 2/20 0.43
HSD17B1 P14061 1/20 0.43
CETP P11597 1/20 0.43

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
SCHEMBL30641659 1.00 MTNR1B (0.56) MTNR1BMTNR1AALDH1A1ALOX15ESR1
SCHEMBL10891966 0.92 MTNR1B (0.49) MTNR1BMTNR1AALDH1A1ALOX15ESR1
SCHEMBL11681116 0.86 MTNR1B (0.67) MTNR1BMTNR1AALDH1A1CETP
SCHEMBL22635886 0.84 MTNR1B (0.55) MTNR1BMTNR1AALOX15ESR1
SCHEMBL4516201 0.84 MTNR1B (0.63) MTNR1BMTNR1AALDH1A1ALOX15HSD17B2
SCHEMBL12219826 0.84 MTNR1A (0.54) MTNR1BMTNR1AALOX15ESR1
SCHEMBL10890808 0.83 CYP3A4 (0.47) MTNR1BMTNR1AALDH1A1CETP
SCHEMBL10770102 0.83 ALDH1A1 (0.44) MTNR1BMTNR1AALDH1A1CETP
SCHEMBL21614161 0.82 MTNR1A (0.52) MTNR1BMTNR1AALOX15
SCHEMBL30817924 0.82 MTNR1A (0.52) MTNR1BMTNR1AALOX15

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080193873-A1 CHANGING LIGHT ABSORPTION BY DISRUPTION OF CONJUGATION VERIFICATION TECHNOLOGIES, INC. (US) 2008-08-14 US claimed
US-20070202290-A1 DATA-PROTECTED DIGITAL RECORDING MEDIA VERIFICATION TECHNOLOGIES, INC. (US) 2007-08-30 US claimed
EP-1810290-A2 CHANGING LIGHT ABSORPTION BY DISRUPTION OF CONJUGATION Verification Technologies, Inc (US) 2007-07-25 EP claimed
EP-1726008-A2 BIS-PROPYLAMINE ANALOG AND COMPOSITION Verificatin Technologies, Inc (US) 2006-11-29 EP claimed
US-20060078707-A1 Changing light absorption by disruption of conjugation SPENCER TRASK HEALTHCARE VENTURES LLC 2006-04-13 US claimed
WO-2006036885-A2 CHANGING LIGHT ABSORPTION BY DISRUPTION OF CONJUGATION VERIFICATION TECHNOLOGIES, INC. (US) 2006-04-06 WO claimed
WO-2005098842-A2 BIS-PROPYLAMINE ANALOG AND COMPOSITION VERIFICATION TECHNOLOGIES, INC. (US) 2005-10-20 WO claimed
US-20040152017-A1 Bis-propyl amine analog and composition VIG RAKESH (US) 2004-08-05 US claimed
EP-1642117-B1 REAGENT STRIPE FOR TEST STRIP ROCHE DIABETES CARE GMBH (DE) 2018-06-13 EP disclosed
US-9798044-B2 Nonlinear optical materials and nonlinear optical device using the same FUJIFILM CORPORATION (JP) 2017-10-24 US disclosed
US-7892849-B2 Reagent stripe for test strip ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-02-22 US disclosed
US-7892849-B2 Reagent stripe for test strip ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-02-22 US disclosed
US-7892849-B2 Reagent stripe for test strip ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-02-22 US disclosed
US-7727467-B2 Reagent stripe for test strip ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2010-06-01 US disclosed
US-5286362-A Reducible substance is enzymatically reduced and oxidized at the electrode; substance formed by oxidation is different from the reducible substance used initially BOEHRINGER MANNHEIM GMBH (DE) 1994-02-15 US disclosed
US-5122244-A Having a reducible nitroso or oxime compound to transfer electrons leading to a signal and form an aromatic amine oxidizable to a compound different from the original; low voltage BOEHRINGER MANNHEIM GMBH (DE) 1992-06-16 US disclosed
EP-0441222-A2 Process and electrode system for determining an analyte or an oxidoreductase as well as suitable compounds Roche Diagnostics GmbH (DE) 1991-08-14 EP disclosed
US-4217102-A Polyamides dyed with rubine disazo acid dyes and process therefore Toms River Chemical Company (US) 1980-08-12 US disclosed
US-4173565-A Rubine disazo acid dyes for polyamides TOMS RIVER CHEMICAL CORPORATION (US) 1979-11-06 US disclosed
US-3936556-A Marking of articles BAYER AKTIENGESELLSCHAFT (DT) 1976-02-03 US disclosed