SCHEMBL447255

SCHEMBL447255

CC(C)(C)N(c1ccc(O)cc1)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.46
ESR2 Q92731 8/20 0.46
CYP3A4 P08684 3/20 0.46
LMNA P02545 2/20 0.46
TYR P14679 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
AR P10275 1/20 0.46
TSHR P16473 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR6 P50406 1/20 0.46
ESRRG P62508 1/20 0.46
SLC6A3 Q01959 1/20 0.46
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
CA12 O43570 1/20 0.42
GMNN O75496 1/20 0.42

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
SCHEMBL22651798 0.77 APP (0.45) ESR1ESR2CYP3A4LMNATYR
SCHEMBL4230096 0.76 ALDH1A1 (0.61) CYP3A4HPGDHSD17B10TSHRALDH1A1
SCHEMBL28335588 0.75 SHBG (0.50) ESR1ESR2CYP3A4LMNATYR
SCHEMBL23325316 0.74 TSHR (0.48) LMNATYRHPGDHSD17B10TSHR
SCHEMBL7175816 0.74 ALDH1A1 (0.52) CYP3A4HPGDHSD17B10TSHRALDH1A1
SCHEMBL9488058 0.74 ALDH1A1 (0.30) HSD17B10TSHRALDH1A1ALOX15
SCHEMBL1829849 0.73 HPGD (0.58) ESR1ESR2LMNAHPGDALDH1A1
SCHEMBL2056786 0.72 MEN1 (0.40) CYP3A4LMNATSHRALDH1A1KDM4E
SCHEMBL3899347 0.72 SLC2A1 (0.42) CYP3A4TSHRMAPT
SCHEMBL6055401 0.72 ALDH1A1 (0.59) ESR1ESR2CYP3A4LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8557754-B2 Composition of biodegradable gear oil COUNSEL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-10-15 US claimed
CN-113100541-B Textile and article and process for manufacturing textile and article 耐克创新有限合伙公司 2022-06-14 CN disclosed
CN-114145542-A Textile and article and process for manufacturing textile and article 耐克创新有限合伙公司 2022-03-08 CN disclosed
CN-110167378-B Textile and article and process for manufacturing textile and article 耐克创新有限合伙公司 2021-11-16 CN disclosed
CN-110167381-B Textile and article and process for manufacturing textile and article 耐克创新有限合伙公司 2021-11-09 CN disclosed
CN-113576109-A Knitted textile and shoe upper and manufacturing method thereof 耐克创新有限合伙公司 2021-11-02 CN disclosed
CN-113100541-A Textile and article and process for manufacturing textile and article 耐克创新有限合伙公司 2021-07-13 CN disclosed
CN-108056532-B Knitted textile and shoe upper and manufacturing method thereof 耐克创新有限合伙公司 2021-06-25 CN disclosed
CN-112639034-A UV curable composition for 3D printing 巴斯夫欧洲公司 2021-04-09 CN disclosed
CN-112638968-A Photocurable composition for 3D printing 巴斯夫欧洲公司 2021-04-09 CN disclosed
US-20120064022-A1 CYCLOSILOXANE-SUBSTITUTED POLYSILOXANE COMPOUNDS, COMPOSITIONS CONTAINING THE COMPOUNDS AND METHODS OF USE THEREOF BIOFILM, INC. 2012-03-15 US disclosed
CN-101544631-A Novel pyrazole 5-lipoxygenase small molecule inhibitors, preparation method, pharmaceutical composition and application thereof SHANGHAI INST MATERIA MEDICA 2009-09-30 CN disclosed
EP-1174477-B1 ANTHRAQUINONE COMPOUND AND WATER-BASED INK-JET RECORDING INK CONTAINING THE COMPOUND MITSUI CHEMICALS INC (JP) 2006-04-26 EP disclosed
CN-1239642-C Anthraquinone compound and aqueous ink for inkjet recording using the same MITSUI CHEMICALS INC (JP) 2006-02-01 CN disclosed
US-6800674-B2 WATER RESISTANCE AND ALSO IN LIGHT FASTNESS AND COMPATIBILITY WITH A RESIN; STORAGE STABILITY; FOR FORMING HIGH-QUALITY UNBLOTTED IMAGE MITSUI CHEMICALS, INC. (JP) 2004-10-05 US disclosed
US-20030078318-A1 Anthraquinone compound and water-based ink-jet recording ink containing the compound MITSUI CHEMICALS, INC. (JP) 2003-04-24 US disclosed
CN-1366543-A Anthraquinone compound and aqueous ink for inkjet recording using the same MITSUI CHEMICALS INC (JP) 2002-08-28 CN disclosed
EP-1174477-A1 ANTHRAQUINONE COMPOUND AND WATER-BASED INK-JET RECORDING INK CONTAINING THE COMPOUND Mitsui Chemicals, Inc. (JP) 2002-01-23 EP disclosed
US-5233089-A Charge transport material; used in electrophotographic plates to provide improved sensitivity, photoresponse and durability HITACHI, LTD. (JP) 1993-08-03 US disclosed
EP-0273426-B1 ENAMINE DERIVATIVES, PRODUCTION THEREOF AND ELECTROPHOTOGRAPHIC PLATES CONTAINING THE SAME Hitachi Chemical Co., Ltd. (JP) 1993-03-17 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 (1 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-20120064022-A1 CYCLOSILOXANE-SUBSTITUTED POLYSILOXANE COMPOUNDS, COMPOSITIONS CONTAINING THE COMPOUNDS AND METHODS OF USE THEREOF PIEZO1, DSC1, PFAS ESR1 1745/4885ESR2 3991/4885CYP3A4 4014/4885

“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.