SCHEMBL598561

SCHEMBL598561

c1ccc(Cc2ccc3ccccc3c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
CYP2A6 P11509 1/20 0.58
CALM1 P0DP23 1/20 0.57
KMT2A Q03164 1/20 0.55
IDH1 O75874 1/20 0.54
ALOX5 P09917 2/20 0.52
TEAD4 Q15561 1/20 0.51
LTA4H P09960 1/20 0.50
CYP2D6 P10635 1/20 0.49
NFKB1 P19838 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
TBXA2R P21731 1/20 0.47
PTGER4 P35408 1/20 0.47
PTGFR P43088 1/20 0.47
PTGER3 P43115 1/20 0.47
PTGER2 P43116 1/20 0.47
PTGDR Q13258 1/20 0.47

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
SCHEMBL29417927 1.00 CYP1A2 (0.58) CYP1A2CYP2A6CALM1KMT2AIDH1
Methane SCHEMBL27919163 0.96 CYP1A2 (0.54) CYP1A2CYP2A6CALM1KMT2AIDH1
SCHEMBL6252461 0.93 CALM1 (0.55) CYP1A2CYP2A6CALM1KMT2AIDH1
SCHEMBL28751550 0.93 CALM1 (0.55) CYP1A2CYP2A6CALM1KMT2AIDH1
SCHEMBL2838141 0.93 CYP1A2 (0.65) CYP1A2CYP2A6KMT2AALOX5TEAD4
SCHEMBL28162726 0.91 CALM1 (0.57) CYP1A2CYP2A6CALM1KMT2AIDH1
SCHEMBL6761421 0.91 CALM1 (0.57) CYP1A2CYP2A6CALM1KMT2AIDH1
SCHEMBL5900962 0.88 CYP1A2 (0.60) CYP1A2CYP2A6KMT2AALOX5TEAD4
SCHEMBL28846677 0.88 CYP1A2 (0.60) CYP1A2CYP2A6KMT2AALOX5TEAD4
SCHEMBL15345357 0.85 ASIC3 (0.58) CYP1A2CYP2A6CALM1IDH1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112026294-A Modified asphalt waterproof coiled material and preparation method thereof 上海建材集团防水材料有限公司 2020-12-04 CN claimed
EP-3060649-A1 REPROGRAMMING CARDIOMYOCYTES WITH ONE TRANSCRIPTION FACTOR The J. David Gladstone Institutes, A Testamentary Trust Established under The Will of J. David Gladstone (US) 2016-08-31 EP claimed
EP-3043822-A1 COMPOSITIONS FOR PREPARING CARDIOMYOCYTES The J. David Gladstone Institutes, A Testamentary Trust Established under The Will of J. David Gladstone (US) 2016-07-20 EP claimed
WO-2015061568-A1 REPROGRAMMING CARDIOMYOCYTES WITH ONE TRANSCRIPTION FACTOR THE J. DAVID GLADSTONE INSTITUTES, A TESTAMENTARY TRUST ESTABLISHED UNDER THE WILL OF J. DAVID GLADSTONE (US) 2015-04-30 WO claimed
WO-2015038704-A1 COMPOSITIONS FOR PREPARING CARDIOMYOCYTES THE J. DAVID GLADSTONE INSTITUTES, A TESTAMENTARY TRUST ESTABLISHED UNDER THE WILL OF J. DAVID GLADSTONE (US) 2015-03-19 WO claimed
US-20250263533-A1 METHOD FOR CONTINUOUSLY RECOVERING STYRENE MONOMER FROM WASTE POLYSTYRENE KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2025-08-21 US disclosed
EP-4512792-A1 METHOD FOR CONTINUOUSLY RECOVERING STYRENE MONOMER FROM WASTE POLYSTYRENE Korea Research Institute of Chemical Technology (KR) 2025-02-26 EP disclosed
US-20250019563-A1 COMPOSITION INCLUDING ADDITION CONDENSATION PRODUCT OF AROMATIC COMPOUND AND CARBONYL COMPOUND AND THIOL COMPOUND, METHOD FOR PRODUCING COMPOSITION, SCALE ADHESION PREVENTION AGENT, REACTION APPARATUS, POLYMER, AND METHOD FOR PRODUCING POLYMER SHIN-ETSU CHEMICAL CO., LTD. (JP) 2025-01-16 US disclosed
CN-119053575-A Method for continuously recovering styrene monomer from waste polystyrene 韩国化学研究院 2024-11-29 CN disclosed
CN-118578804-A Thermosensitive recording material 乐凯医疗科技有限公司 2024-09-03 CN disclosed
US-11829036-B2 Optically anisotropic multilayer product and method for producing same ZEON CORPORATION (JP) 2023-11-28 US disclosed
CN-113943199-B Method for synthesizing amide compound by using nitrile and diaryl methane as raw materials 浙江工业大学 2023-09-22 CN disclosed
EP-0261175-A1 FIBEROUS BATT AND METHOD FOR PRODUCING SUCH FIBERLOK, INC. (US) 1988-03-30 EP disclosed
CN-87102669-A Fiberboard and manufacture method thereof 1987-12-30 CN disclosed
WO-1987005639-A1 FIBEROUS BATT AND METHOD FOR PRODUCING SUCH FIBERLOK, INC. (US) 1987-09-24 WO disclosed
EP-0123493-B1 PHOTOCHEMICAL CONVERSION AND STORAGE OF LIGHT ENERGY BY PHOTOISOMERIZATION OF COMPOUNDS SUCH AS NORBORNADIENE AND ITS DERIVATIVES THE STANDARD OIL COMPANY (US) 1987-07-22 EP disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed
EP-0123493-A1 Photochemical conversion and storage of light energy by photoisomerization of compounds such as norbornadiene and its derivatives THE STANDARD OIL COMPANY (US) 1984-10-31 EP disclosed
US-3936473-A COPPER OR NOBLE METAL SALT, OXYGEN AND ORGANIC ACID CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-02-03 US disclosed