SCHEMBL2222701

SCHEMBL2222701

C=Cc1ccc(C)c(C)c1CN

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
SCHEMBL27343969 0.85 TAAR1 (0.36)
SCHEMBL9310987 0.82 NOS3 (0.31)
Ammonia Solution, Strong SCHEMBL22472015 0.80
SCHEMBL9310237 0.78 NOS2 (0.34)
SCHEMBL25433547 0.77 THRA (0.34)
SCHEMBL14100533 0.76 ALDH1A1 (0.34)
SCHEMBL11498943 0.76 THRB (0.36)
SCHEMBL395903 0.75 POLB (0.35)
SCHEMBL29253331 0.74
SCHEMBL29618949 0.73 MAPT (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9783671-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on unsaturated polyesters Fachhochschule Münster (DE) 2017-10-10 US claimed
EP-1147138-A1 HYDROPHILIC AMPHOLYTIC POLYMER The B.F. Goodrich Company (US) 2001-10-24 EP claimed
WO-2000039176-A1 HYDROPHILIC AMPHOLYTIC POLYMER THE B.F. GOODRICH COMPANY (US) 2000-07-06 WO claimed
EP-2345312-B1 APPARATUS AND METHOD FOR TREATING AN OBJECT BY PLASMA TNO (NL) 2018-05-30 EP disclosed
US-9803091-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on vinyl esters and vinyl ester urethanes Fachhochschule Münster (DE) 2017-10-31 US disclosed
US-9783671-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on unsaturated polyesters Fachhochschule Münster (DE) 2017-10-10 US disclosed
US-20170049801-A1 MULTIBLOCK COPOLYMERS UNIVERSITY OF WASHINGTON (US) 2017-02-23 US disclosed
US-20150361259-A1 CROSS-LINKED PLASTIC MATERIAL WITH AN INTRINSIC ANTIMICROBIAL EFFECT BASED ON UNSATURATED POLYESTERS Fachhochschule Münster (DE) 2015-12-17 US disclosed
US-20150361277-A1 CROSS-LINKED PLASTIC MATERIAL WITH AN INTRINSIC ANTIMICROBIAL EFFECT BASED ON VINYL ESTERS AND VINYL ESTER URETHANES Fachhochschule Münster (DE) 2015-12-17 US disclosed
US-20130222882-A1 POLYMER DISPERSANT FOR IMAGE DISPLAY PARTICLES, IMAGE DISPLAY PARTICLES, DISPERSION LIQUID FOR IMAGE DISPLAY PARTICLES, DISPLAY MEDIUM, AND DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2013-08-29 US disclosed
WO-2013025480-A1 METHODS OF COATING SURFACES USING INITIATED PLASMA-ENHANCED CHEMICAL VAPOR DEPOSITION MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-02-21 WO disclosed
EP-1281516-B1 Planographic printing plate precursor FUJIFILM CORP (JP) 2007-12-19 EP disclosed
US-6951171-B2 Using graft polymer on etched or anodized aluminum substrate FUJI PHOTO FILM CO., LTD. (JP) 2005-10-04 US disclosed
US-20040208834-A1 Oral-use polymer and oral-use composition KAO CORPORATION (JP) 2004-10-21 US disclosed
EP-1413589-A1 POLYMERS FOR ORAL USE AND COMPOSITIONS FOR ORAL USE Kao Corporation (JP) 2004-04-28 EP disclosed
US-20030129520-A1 Using graft polymer on etched or anodized aluminum substrate FUJIFILM CORPORATION (JP) 2003-07-10 US disclosed
EP-1281516-A2 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2003-02-05 EP disclosed
US-6361768-B1 POLYMER FORMED BY COPOLYMERIZATION OF ANIONIC MONOMER HAVING CARBOXY-FUNCTIONAL GROUP, NON-QUATERNIZED CATIONIC MONOMER HAVING AMINO-FUNCTIONAL GROUP, NON-IONIC HYDROPHILIC MONOMER, HYDROPHOBIC MONOMER, OPTIONAL CROSSLINKING MONOMER PMD HOLDINGS CORP. 2002-03-26 US disclosed
EP-1147138-A1 HYDROPHILIC AMPHOLYTIC POLYMER The B.F. Goodrich Company (US) 2001-10-24 EP disclosed
WO-2000039176-A1 HYDROPHILIC AMPHOLYTIC POLYMER THE B.F. GOODRICH COMPANY (US) 2000-07-06 WO disclosed