SCHEMBL668098

SCHEMBL668098

CCCCCCCCCCCCNC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 10/20 0.50
TSHR P16473 3/20 0.48
ALDH1A1 P00352 1/20 0.48
THRB P10828 1/20 0.44
ADH1B P00325 1/20 0.44
ADH1C P00326 1/20 0.44
ADH1A P07327 1/20 0.44
ADH4 P08319 1/20 0.44
ADH7 P40394 1/20 0.44
HRH4 Q9H3N8 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
PPARA Q07869 2/20 0.39
GBA1 P04062 1/20 0.38
CASP2 P42575 1/20 0.38

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
SCHEMBL983390 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL668300 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL7777014 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL7776706 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL5508330 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL5504517 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL15171894 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL41714 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL8421553 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B
SCHEMBL7174533 1.00 EPHX1 (0.50) EPHX1TSHRALDH1A1THRBADH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110530055-B Absorption type water chiller/heater, refill liquid for absorption type water chiller/heater, absorption liquid for absorption type water chiller/heater, and maintenance method 株式会社克莱瑞斯 2021-08-20 CN claimed
US-20250019482-A1 SYNTHESIS AND FABRICATION OF MECHANICALLY ROBUST AND MESOPOROUS ABAC TETRABLOCK POLYMER MEMBRANES FOR ULTRAFILTRATION U.S. DEPARTMENT OF ENERGY 2025-01-16 US disclosed
CN-115667626-B Microfibrous cellulose, dispersion, sheet, laminate, and process for producing microfibrous cellulose 王子控股株式会社 2025-01-10 CN disclosed
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-01-25 US disclosed
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2023-11-16 US disclosed
US-20220152196-A1 SAPONIN-BASED VACCINE ADJUVANTS THE UAB RESEARCH FOUNDATION 2022-05-19 US disclosed
CN-112654746-B Fibrous cellulose-containing material, fluffed cellulose, and composition 王子控股株式会社 2022-04-29 CN disclosed
CN-111373000-B Resin composition containing fibrous cellulose, sheet and molded body 王子控股株式会社 2022-02-25 CN disclosed
CN-110530055-B Absorption type water chiller/heater, refill liquid for absorption type water chiller/heater, absorption liquid for absorption type water chiller/heater, and maintenance method 株式会社克莱瑞斯 2021-08-20 CN disclosed
CN-110530055-B Absorption type water chiller/heater, refill liquid for absorption type water chiller/heater, absorption liquid for absorption type water chiller/heater, and maintenance method 株式会社克莱瑞斯 2021-08-20 CN disclosed
US-20120046244-A1 DUAL FUNCTIONING IONIC LIQUIDS AND SALTS THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2012-02-23 US disclosed
WO-2012006313-A2 HERBICIDAL COMPOSITIONS AND METHODS OF USE THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2012-01-12 WO disclosed
WO-2010078300-A1 DUAL FUNCTIONING IONIC LIQUIDS AND SALTS THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2010-07-08 WO disclosed
US-20100021695-A1 ENGRAVED PLATE AND SUBSTRATE WITH CONDUCTOR LAYER PATTERN USING THE SAME HITACHI CHEMICAL COMPANY, LTD. (JP) 2010-01-28 US disclosed
EP-2098362-A1 ENGRAVED PLATE AND BASE MATERIAL HAVING CONDUCTOR LAYER PATTERN USING THE ENGRAVED PLATE Hitachi Chemical Company, Ltd. (JP) 2009-09-09 EP disclosed
EP-1931760-A2 MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS The University of Alabama (US) 2008-06-18 EP disclosed
US-20080031906-A1 Cosmetic Composition and Method for Producing the Same HAKUTO CO., LTD. (JP) 2008-02-07 US disclosed
EP-1820538-A1 COSMETICS AND PROCESS FOR PRODUCTION THEREOF Hakuto Co., Ltd (JP) 2007-08-22 EP disclosed
US-20070093462-A1 Multi-functional ionic liquid compositions for overcoming polymorphism and imparting improved properties for active pharmaceutical, biological, nutritional, and energetic ingredients BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA 2007-04-26 US disclosed
WO-2007044693-A2 MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS THE UNIVERSITY OF ALABAMA (US) 2007-04-19 WO 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 (6 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-20070093462-A1 Multi-functional ionic liquid compositions for overcoming polymorphism and imparting improved properties for active pharmaceutical, biological, nutritional, and energetic ingredients SLC5A6, PNLIP, IPMK EPHX1 3269/4885TSHR 4253/4885ALDH1A1 2937/4885
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF MDM2, TP53, MDM4 EPHX1 2320/4885TSHR 3455/4885ALDH1A1 1804/4885
US-20080031906-A1 Cosmetic Composition and Method for Producing the Same LIPA, CUTA, PLIN3 EPHX1 1435/4885TSHR 1851/4885ALDH1A1 3364/4885
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF KRAS, NRAS, BRAF EPHX1 4256/4885TSHR 4687/4885ALDH1A1 3174/4885
US-20120046244-A1 DUAL FUNCTIONING IONIC LIQUIDS AND SALTS THEREOF SLC6A6, SLC10A2, CLK2 EPHX1 4482/4885TSHR 3455/4885ALDH1A1 3146/4885
US-20220152196-A1 SAPONIN-BASED VACCINE ADJUVANTS ST3GAL3, B3GAT3, CSGALNACT1 EPHX1 2474/4885TSHR 3151/4885ALDH1A1 4710/4885

“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.