SCHEMBL11994

SCHEMBL11994

Cc1ccc2cc[nH]c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.56
CMA1 P23946 1/20 0.56
TYR P14679 1/20 0.56
MEN1 O00255 1/20 0.55
POLB P06746 1/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 1/20 0.55
ESR1 P03372 1/20 0.51
CYP19A1 P11511 1/20 0.51
CYP2A6 P11509 4/20 0.50
ENPP2 Q13822 2/20 0.50
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CYP1A2 P05177 2/20 0.48
GPR84 Q9NQS5 1/20 0.46
TRPA1 O75762 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46

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
SCHEMBL29556250 1.00 AHR (0.56) AHRCMA1TYRMEN1POLB
Ethyne SCHEMBL28266950 0.96 AHR (0.52) AHRCMA1TYRMEN1POLB
SCHEMBL17291794 0.92 MEN1 (0.48) AHRCMA1TYRMEN1POLB
Pyridine SCHEMBL28518714 0.85 MEN1 (0.43) AHRCMA1TYRMEN1POLB
SCHEMBL15676484 0.83 CYP2A6 (0.52) AHRCMA1TYRMEN1POLB
SCHEMBL13115618 0.83 BRD4 (0.53) AHRCMA1TYRMEN1POLB
SCHEMBL8186590 0.82 CYP2A6 (0.44) AHRCMA1TYRMEN1POLB
Benzoic Acid SCHEMBL11438463 0.81 ALDH1A1 (0.63) TYRMEN1KMT2AESR1CYP19A1
Phenylacetylene SCHEMBL28268693 0.81 AHR (0.40) AHRCMA1TYRMEN1POLB
SCHEMBL30882 0.81 AHR (0.56) AHRCYP2A6CYP1A2GPR84TRPA1

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 2256 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4330184-B1 METHOD FOR SYNTHESISING A LIQUID ORGANIC HYDROGEN CARRIER (LOHC) LOADED WITH HYDROGEN USING HYDROGEN PRODUCED FROM A METHANISATION DIGESTATE COMMISSARIAT ENERGIE ATOMIQUE (FR) 2025-02-12 EP claimed
CN-119350324-A 6-Methylindole [1,2-a ] quinoxaline compound and synthetic method thereof 陕西科技大学 2025-01-24 CN claimed
CN-116199597-B Substituted phenyl diazonium salt and application thereof in catalytic preparation of 3-substituted indole compounds 盐城利民农化有限公司 2024-12-03 CN claimed
CN-118546083-B Method and system for synthesizing indole and derivative thereof by alcohol amine method 陕西氢易能源科技有限公司 2024-12-03 CN claimed
CN-118546083-A Method and system for synthesizing indole and derivative thereof by alcohol amine method 陕西氢易能源科技有限公司 2024-08-27 CN claimed
US-20240228269-A9 METHOD FOR SYNTHESISING A LIQUID ORGANIC HYDROGEN CARRIER (LOHC) LOADED WITH HYDROGEN USING HYDROGEN PRODUCED FROM A METHANISATION DIGESTATE COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2024-07-11 US claimed
CN-118125960-A Bisindole 3-ketone compound, application and preparation method thereof 云南农业大学 2024-06-04 CN claimed
US-20240132343-A1 METHOD FOR SYNTHESISING A LIQUID ORGANIC HYDROGEN CARRIER (LOHC) LOADED WITH HYDROGEN USING HYDROGEN PRODUCED FROM A METHANISATION DIGESTATE COMMISSARIAT ENERGIE ATOMIQUE (FR) 2024-04-25 US claimed
EP-4330184-A1 METHOD FOR SYNTHESISING A LIQUID ORGANIC HYDROGEN CARRIER (LOHC) LOADED WITH HYDROGEN USING HYDROGEN PRODUCED FROM A METHANISATION DIGESTATE Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2024-03-06 EP claimed
CN-116199597-A Substituted phenyl diazonium salt and application thereof in catalytic preparation of 3-substituted indole compounds 盐城利民农化有限公司 2023-06-02 CN claimed
WO-2003097608-A2 OPIOID AND OPIOID-LIKE COMPOUNDS AND USES THEREOF JENKEN BIOSCIENCES, INC. (US) 2003-11-27 WO claimed
US-20030213553-A1 Composition and method for preparing chemically-resistant roughened copper surfaces for bonding to substrates MACDERMID, INCORPORATED 2003-11-20 US claimed
CN-1451031-A Method for roughening copper surfaces for bonding to substrates ELECTROCHEMICALS INC (US) 2003-10-22 CN claimed
JP-2003519286-A 2003-06-17 JP claimed
US-6513439-B2 Apparatus for marking a target DON-B CORPORATION 2003-02-04 US claimed
EP-1255797-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2002-11-13 EP claimed
WO-2001001996-A9 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OSTEOPOROSIS UNIV WESTERN AUSTRALIA (AU) 2002-09-12 WO claimed
US-20020112640-A1 Apparatus for marking a target DON-B CORPORATION 2002-08-22 US claimed
WO-2001049805-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2001-07-12 WO claimed
WO-2001001996-A1 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OSTEOPOROSIS UNIVERSITY OF WESTERN AUSTRALIA (AU) 2001-01-11 WO claimed