SCHEMBL348623

SCHEMBL348623

CC(C)(C)c1ccc(Cc2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2B P18089 1/20 0.52
ADRA2C P18825 1/20 0.52
ADRA1D P25100 1/20 0.52
HTR1D P28221 1/20 0.52
HTR1B P28222 1/20 0.52
ADRA1A P35348 1/20 0.52
ADRA1B P35368 1/20 0.52
LMNA P02545 2/20 0.50
TYR P14679 1/20 0.50
KCNH2 Q12809 1/20 0.48
TP53 P04637 1/20 0.48
BCHE P06276 4/20 0.48
ACHE P22303 4/20 0.48
ALDH1A1 P00352 2/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 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
SCHEMBL3452699 0.90 CALM1 (0.57) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL6547963 0.90 TSHR (0.71) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL6284119 0.88 SMN1; SMN2 (0.49) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL19936605 0.88 ESR1 (0.52) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL9440498 0.88 APP (0.61) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL23009776 0.88 ADRA2A (0.44) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL12733320 0.88 LMNA (0.73) TSHRLMNATYRALDH1A1
SCHEMBL270340 0.86 ALDH1A1 (0.62) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL19599172 0.86 SLC22A2 (0.45) TSHRADRA2AADRA2BADRA2CADRA1D
SCHEMBL24515353 0.84 TSHR (0.43) TSHRADRA2AADRA2BADRA2CADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6503662-B1 Tert-butylbenzene derivative prevents oxidation and decomposition of solvent at the time of charging which causes decreased battery characteristics UBE INDUSTRIES, LTD. (JP) 2003-01-07 US claimed
US-12398089-B2 Method for preparing organic carboxylic ester by using combined catalyst of aryl bidentate phosphine ligand NANJING CHENGZHI CLEAN ENERGY CO. LTD. (CN) 2025-08-26 US disclosed
US-11723990-B2 Library of pH responsive polymers and nanoprobes thereof THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-08-15 US disclosed
EP-4062894-A1 DENTAL PHOTOCURABLE COMPOSITION HAVING EXCELLENT STORAGE STABILITY Shofu Inc. (JP) 2022-09-28 EP disclosed
US-20220298097-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY USING COMBINED CATALYST OF ARYL BIDENTATE PHOSPHINE LIGAND NANJING CHENGZHI CLEAN ENERGY CO. LTD. (CN) 2022-09-22 US disclosed
US-20220287919-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH SHOFU INC. (JP) 2022-09-15 US disclosed
WO-2021129138-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY MEANS OF COMBINATORIAL CATALYSIS WITH ARYL BIDENTATE PHOSPHINE LIGAND 南京诚志清洁能源有限公司 2021-07-01 WO disclosed
WO-2020243381-A1 FAST PHOTOCURABLE POLYCYCLOOLEFIN COMPOSITIONS AS OPTICAL OR 3D PRINTING MATERIALS PROMERUS, LLC (US) 2020-12-03 WO disclosed
CN-111087306-A Method for preparing organic carboxylic ester by aryl bidentate phosphine ligand combined catalysis 南京诚志清洁能源有限公司 2020-05-01 CN disclosed
US-9869929-B2 Resin, resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-16 US disclosed
US-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1138687-A1 METALLOCENE COMPOUND, PROCESS FOR PRODUCING METALLOCENE COMPOUND, OLEFIN POLYMERIZATION CATALYST, PROCESS FOR PRODUCING POLYOLEFIN, AND POLYOLEFIN Mitsui Chemicals, Inc. (JP) 2001-10-04 EP disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed
EP-0693468-B1 A method of making Diaryliodonium fluoroalkyl sulphonate salts MINNESOTA MINING & MFG (US) 1999-06-09 EP disclosed
US-5710320-A Diaryliodonium fluoroalkyl sulfonate salts and a method of making MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-01-20 US disclosed
US-5488147-A Diaryliodonium fluoroalkyl sulfonate salts and a method of making MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-30 US disclosed
EP-0693468-A2 Diaryliodonium fluoroalkyl sulphonate salts and a method of making them MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-24 EP disclosed
US-4814483-A IRON CHLORIDE CATALYZED REACTION BAYER AKTIENGESELLSCHAFT (DE) 1989-03-21 US disclosed
EP-0226152-B1 PROCESS FOR PREPARING OPTIONALLY-SUBSTITUTED 2-BENZYL TOLUENES BAYER AG (DE) 1989-01-18 EP disclosed
EP-0226152-A1 Process for preparing optionally-substituted 2-benzyl toluenes BAYER AG (DE) 1987-06-24 EP disclosed

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

For each of this compound's patents that has machine-readable text (4 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-20220287919-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH ODC1, AOC2, CCNT1 TSHR 4012/4885ADRA2A 1573/4885ADRA2B 1406/4885
US-20220298097-A1 METHOD FOR PREPARING ORGANIC CARBOXYLIC ESTER BY USING COMBINED CATALYST OF ARYL BIDENTATE PHOSPHINE LIGAND POF1B, ADH1C, OSBP TSHR 2891/4885ADRA2A 3967/4885ADRA2B 3785/4885
US-12398089-B2 Method for preparing organic carboxylic ester by using combined catalyst of aryl bidentate phosphine ligand POF1B, ADH1C, OSBP TSHR 2891/4885ADRA2A 3967/4885ADRA2B 3785/4885
US-11723990-B2 Library of pH responsive polymers and nanoprobes thereof MSN, CD44, CD47 TSHR 4300/4885ADRA2A 4696/4885ADRA2B 4576/4885

“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.