SCHEMBL2895095

SCHEMBL2895095

O=[N+]([O-])C1OCCCO1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3688339 0.69 ALDH1A1 (0.37)
SCHEMBL17673074 0.67
SCHEMBL30529706 0.65 GSR (0.31)
Nitromethane SCHEMBL4964841 0.63
Nitric Acid SCHEMBL9803877 0.63
SCHEMBL11476347 0.63
SCHEMBL10501292 0.61
SCHEMBL10352299 0.59
SCHEMBL3071574 0.57 TSHR (0.42)
SCHEMBL4141535 0.54 TSHR (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773270-B2 Effect pigments MERCK PATENT GMBH (DE) 2023-10-03 US disclosed
US-10822497-B2 Interference pigments MERCK PATENT GMBH (DE) 2020-11-03 US disclosed
US-20200339820-A1 EFFECT PIGMENTS MERCK PATENT GMBH (DE) 2020-10-29 US disclosed
EP-3658166-A1 NOVEL CROP FORTIFICATION, NUTRITION AND CROP PROTECTION COMPOSITION Sawant, Arun Vitthal (IN) 2020-06-03 EP disclosed
WO-2019199865-A1 QUANTIFICATION OF BIOMARKERS PRESENT IN DRIED PHYSIOLOGICAL SAMPLES Quanterix Corporation (US) 2019-10-17 WO disclosed
CN-109562041-A Solid cleaning compositions with taurine and methods thereof 高露洁-棕榄公司 2019-04-02 CN disclosed
WO-2019021250-A1 NOVEL CROP FORTIFICATION, NUTRITION AND CROP PROTECTION COMPOSITION SAWANT ARUN VITTHAL (IN) 2019-01-31 WO disclosed
CN-104704373-B Purposes of the antioxidant in the method and apparatus detected for blood sample target 微型照顾私人有限公司 2018-11-16 CN disclosed
EP-3397252-A1 PERSONAL CARE COMPOSITIONS Colgate-Palmolive Company (US) 2018-11-07 EP disclosed
CN-105541785-B The post-processing approach of the dioxacyclohexanes of 2,2 dimethyl, 5 nitro, 5 nitroso 1,3 西安近代化学研究所 2017-12-22 CN disclosed
US-20080286748-A1 BLOOD COLLECTION TUBE WITH SURFACTANT STRECK, INC. (US) 2008-11-20 US disclosed
WO-2008083323-A9 DETECTION APPARATUS INVITROGEN CORP (US) 2008-09-12 WO disclosed
US-7419832-B2 Transparent barrier allows optical detection of sedimentation rate; elongated, open at one end; antimicrobials, anticoagulants, preservatives STRECK, INC. (US) 2008-09-02 US disclosed
WO-2008083323-A1 DETECTION APPARATUS INVITROGEN CORPORATION (US) 2008-07-10 WO disclosed
US-20080047470-A1 Effect pigments SUSONITY Commercial GmbH (DE) 2008-02-28 US disclosed
US-20060210429-A1 Blood collection tube with surfactant STRECK, INC. (US) 2006-09-21 US disclosed
EP-1701148-A2 Blood collection tube Streck Inc. (US) 2006-09-13 EP disclosed
US-20060002875-A1 Diffractive colorants for cosmetics MERCK PATENT GMBH (DE) 2006-01-05 US disclosed
US-20050176850-A1 Interference pigments MERCK PATENT GMBH (DE) 2005-08-11 US disclosed
US-4025533-A BACTERICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1977-05-24 US disclosed