SCHEMBL504079

SCHEMBL504079

C1#Cc2ccccc2-c2ccccc2CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.40
MAOA P21397 3/20 0.36
MAOB P27338 2/20 0.36
CYP2A6 P11509 1/20 0.36
NOS3 P29474 2/20 0.34
NOS2 P35228 1/20 0.34
PDPK1 O15530 1/20 0.34
PARP1 P09874 1/20 0.34
PARP10 Q53GL7 1/20 0.34
PARP11 Q9NR21 1/20 0.34
SRD5A1 P18405 1/20 0.34
SRD5A2 P31213 1/20 0.34
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BCHE P06276 1/20 0.33
SETD7 Q8WTS6 1/20 0.32
TSHR P16473 1/20 0.32
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
NPC1 O15118 1/20 0.31

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
SCHEMBL29390452 1.00 CES1 (0.40) CES1MAOAMAOBCYP2A6NOS3
Ammonia Solution, Strong SCHEMBL28819102 0.98 CES1 (0.39) CES1MAOAMAOBCYP2A6NOS3
Ethylene SCHEMBL28524974 0.96 CES1 (0.38) CES1MAOAMAOBCYP2A6NOS3
Hydrochloric Acid SCHEMBL28015311 0.96 CES1 (0.38) CES1MAOAMAOBCYP2A6NOS3
SCHEMBL26073062 0.93 CES1 (0.35) CES1MAOAMAOBCYP2A6NOS3
SCHEMBL29537848 0.93 CES1 (0.35) CES1MAOAMAOBCYP2A6NOS3
SCHEMBL16390503 0.89 CES1 (0.33) CES1MAOAMAOBCYP2A6
SCHEMBL15226317 0.89 CES1 (0.33) CES1MAOAMAOBCYP2A6NOS3
SCHEMBL29858826 0.87 CES1 (0.34) CES1MAOAMAOBCYP2A6NOS3
SCHEMBL27905624 0.87 CES1 (0.32) CES1PDPK1PARP1PARP10PARP11

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

Appears in 7492 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747409-A2 COLLECTION, ASSESSMENT AND EARLY DETECTION OF HUMAN LUNG CANCER BIOMARKERS IN EXHALED BREATH CONDENSATES OF MOUSE ANIMAL MODELS Hackensack Meridian Health, Inc. (US) 2026-05-27 EP claimed
CN-122071742-A High-sensitivity tumor mutation detection method based on co-primer co-F 张家港市第一人民医院 2026-05-22 CN claimed
CN-122071705-A Lactose modified nucleic acid, preparation method thereof and application thereof in CRISPR-Cas9 inhibition 南京师范大学 2026-05-22 CN claimed
CN-122063266-A Preparation method and application of novel azobenzene modified nanopore probe 绵阳师范学院 2026-05-19 CN claimed
WO-2026102134-A1 ANALYTE BINDING COMPOSITIONS, METHODS, AND SYSTEMS FREENOME HOLDINGS, INC. (US) 2026-05-15 WO claimed
US-20260132456-A1 Methods for Extraction and Sequencing of Nucleic Acid EARLHAM ENTPR LTD (GB) 2026-05-14 US claimed
EP-4739804-A1 METHODS AND COMPOSITIONS FOR CHARACTERIZING VIRAL PARTICLES IN A BIOLOGICAL SAMPLE NanoMosaic Inc. (US) 2026-05-13 EP claimed
CN-122010900-A Organic ionic liquid formed by mixing double medicaments and application thereof 苏州大学 2026-05-12 CN claimed
CN-122005857-A Double-antibody modified vesicle STING agonist, preparation method and application 苏州大学 2026-05-12 CN claimed
CN-119688896-B Cell membrane bionic nano-recognition material and preparation method and application thereof 陕西科技大学 2026-05-12 CN claimed
US-20120322974-A9 ALKYNES AND METHODS OF REACTING ALKYNES WITH 1,3-DIPOLE-FUNCTIONAL COMPOUNDS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-12-20 US claimed
WO-2012174136-A1 CHELATED PSMA INHIBITORS CANCER TARGETED TECHNOLOGY LLC (US) 2012-12-20 WO claimed
WO-2012166653-A2 METHODS FOR COUPLING TARGETING PEPTIDES ONTO RECOMBINANT LYSOSOMAL ENZYMES FOR IMPROVED TREATMENTS OF LYSOSOMAL STORAGE DISEASES CALLIDUS BIOPHARMA, INC. (US) 2012-12-06 WO claimed
US-8258347-B2 Cyclopropenones and the photochemical generation of cyclic alkynes therefrom UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-09-04 US claimed
US-20120208722-A1 SURFACE ENHANCED RAMAN SPECTROSCOPY PLATFORMS AND METHODS NATIONAL INSTITUTES OF HEALTH 2012-08-16 US claimed
US-20120172575-A1 ALKYNES AND METHODS OF REACTING ALKYNES WITH 1,3-DIPOLE-FUNCTIONAL COMPOUNDS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-07-05 US claimed
WO-2012047663-A2 METHODS INCLUDING LATENT 1,3-DIPOLE-FUNCTIONAL COMPOUNDS AND MATERIALS PREPARED THEREBY UNIVERSITY OF GEORGIA REASERCH FOUNDATION, INC. (US) 2012-04-12 WO claimed
US-20120053299-A1 Cyclopropenones and the Photochemical Generation of Cyclic Alkynes Therefrom UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-03-01 US claimed
WO-2012006556-A2 DETECTION OF ANALYTES Life Technologies Corporation (US) 2012-01-12 WO claimed
US-20100210854-A1 Cyclopropenones and the Photochemical Generation of Cyclic Alkynes Therefrom UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2010-08-19 US claimed