SCHEMBL536458

SCHEMBL536458

Oc1ccc2cc3ccccc3cc2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.84
ESR2 Q92731 8/20 0.60
ESR1 P03372 7/20 0.60
CYP3A4 P08684 3/20 0.54
ALOX15 P16050 2/20 0.54
HIF1A Q16665 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
TSHR P16473 1/20 0.54
HSD17B1 P14061 2/20 0.54
HSD17B2 P37059 2/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2B6 P20813 1/20 0.54
CYP2C19 P33261 1/20 0.54
MEN1 O00255 2/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
KMT2A Q03164 2/20 0.52
CLK1 P49759 1/20 0.52

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
SCHEMBL3790145 1.00 CYP1A2 (0.84) CYP1A2ESR2ESR1CYP3A4ALOX15
SCHEMBL29410413 1.00 CYP1A2 (0.84) CYP1A2ESR2ESR1CYP3A4ALOX15
SCHEMBL31320915 1.00 CYP1A2 (0.84) CYP1A2ESR2ESR1CYP3A4ALOX15
SCHEMBL3251983 1.00 CYP1A2 (0.84) CYP1A2ESR2ESR1CYP3A4ALOX15
Methane SCHEMBL7865282 0.97 CYP1A2 (0.80) CYP1A2ESR2ESR1CYP3A4ALOX15
Anthracene SCHEMBL28283702 0.97 CYP1A2 (0.90) CYP1A2ESR2ESR1CYP3A4ALOX15
Betanaphthol SCHEMBL11026449 0.94 CYP1A2 (0.94) CYP1A2ESR2ESR1CYP3A4ALOX15
Betanaphthol SCHEMBL11594695 0.92 CYP1A2 (1.00) CYP1A2ESR2ESR1CYP3A4ALOX15
Betanaphthol SCHEMBL28781 0.92 CYP1A2 (1.00) CYP1A2ESR2ESR1CYP3A4ALOX15
Betanaphthol SCHEMBL239472 0.92 CYP1A2 (1.00) CYP1A2ESR2ESR1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119620541-A Preparation and application of bottom anti-reflection coating with high etching rate 儒芯微电子材料(上海)有限公司 2025-03-14 CN claimed
CN-113024587-A Condensed aromatic derivative containing boron and nitrogen, method for preparing same, and organic electroluminescent device 吉林奥来德光电材料股份有限公司 2021-06-25 CN claimed
WO-2021042001-A1 COMPOSITIONS AND METHODS RELATED TO DISSOLVED OXIDES Natural Extraction Systems, LLC (US) 2021-03-04 WO claimed
US-20170158609-A1 Method For Synthesizing Catecholamines By Using Plasma Polymerization CHEORWON PLASMA RESEARCH INSTITUTE (KP) 2017-06-08 US claimed
US-20150021523-A1 Processes For Forming Alkylated Aryl Phosphite Compositions From Complex Hydrocarbon Streams ADDIVANT USA LLC (US) 2015-01-22 US claimed
US-8900416-B2 Production of higher quality bio-oils by in-line esterification of pyrolysis vapor UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2014-12-02 US claimed
US-8735628-B2 Processes for forming alkylated aryl phosphite compositions from complex hydrocarbon streams ADDIVANT USA LLC (US) 2014-05-27 US claimed
US-8557886-B2 Storage-stable polyol compositions for producing rigid polyisocyanurate foam DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-15 US claimed
US-20130172705-A1 ENZYME CO-FACTOR ENHANCEMENT OF BIOSENSOR PERFORMANCE PINNACLE TECHNOLOGY, INC. (US) 2013-07-04 US claimed
EP-2414422-B1 STORAGE-STABLE POLYOL COMPOSITIONS FOR PRODUCING RIGID POLYISOCYANURATE FOAM DOW GLOBAL TECHNOLOGIES LLC (US) 2013-01-23 EP claimed
CN-1330774-C Kynurenine hydrolase polymorphism and its diagnostic use SOUTHERN RES CT OF STATE HUMAN (CN) 2007-08-08 CN claimed
US-20060105412-A1 Sulfonate compound and fluorescent probe using the same OSAKA INDUSTRIAL PROMOTION ORGANIZATION (JP) 2006-05-18 US claimed
US-20060105410-A1 Sulfonate compound and fluorescent probe using the same OSAKA INDUSTRIAL PROMOTION ORGANIZATION (JP) 2006-05-18 US claimed
EP-1546139-A1 DERIVATIVE OF DIHYDRO-DIBENZO (A) ANTHRACENES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-29 EP claimed
WO-2004029047-A1 DERIVATIVE OF DIHYDRO-DIBENZO (A) ANTHRACENES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-04-08 WO claimed
CN-1442487-A Kynurenine hydrolase polymorphism and its diagnostic use SOUTHERN RES CT OF STATE HUMAN (CN) 2003-09-17 CN claimed
US-RE32943-E SOLUBILIZING, STABILIZING HONSHU SEISHI KABUSHIKI KAISHA (JP) 1989-06-06 US claimed
US-4533766-A Process for the production of dihydroxybenzenes DEGUSSA AKTIENGESELLSCHAFT (DE) 1985-08-06 US claimed
US-4323714-A Alkylation of hydroxy-substituted aromatic compounds UOP INC. (US) 1982-04-06 US claimed
US-4181565-A Process for cooking lignocellulosic material in the presence of hydroxyanthracenes and derivatives thereof HONSHU SEISHI KABUSHIKI KAISHA (JP) 1980-01-01 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060105410-A1 Sulfonate compound and fluorescent probe using the same BRS3, NCOA3, NR4A3 CYP1A2 2149/4885ESR2 165/4885ESR1 431/4885
US-20060105412-A1 Sulfonate compound and fluorescent probe using the same SLCO1B3, CBR3, SLCO2B1 CYP1A2 1177/4885ESR2 1992/4885ESR1 1653/4885
US-20170158609-A1 Method For Synthesizing Catecholamines By Using Plasma Polymerization COMT, PNMT, PAH CYP1A2 47/4885ESR2 3762/4885ESR1 1901/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.