SCHEMBL131127

SCHEMBL131127

CC[CH]C(=O)OCCCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.68
TSHR P16473 5/20 0.63
HPGD P15428 1/20 0.63
HCAR2 Q8TDS4 4/20 0.59
ALDH1A1 P00352 2/20 0.54
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NAAA Q02083 1/20 0.43
APP P05067 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 1/20 0.42
CYP3A4 P08684 1/20 0.41
EPHX1 P07099 1/20 0.41
ESR1 P03372 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL5069215 0.93 HCAR2 (0.60) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL5634629 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL8895622 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL5065159 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL1569307 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL5164297 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL8896165 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL8896227 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL8895057 0.91 HCAR2 (0.61) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL129368 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1602011-A2 PHOTORESIST COMPOSITION FOR DEEP ULTRAVIOLET LITHOGRAPHY AZ Electronic Materials USA Corp. (US) 2005-12-07 EP claimed
US-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation PHARMACIA AND UPJOHN COMPANY LLC 2005-09-08 US claimed
WO-2005037797-A1 SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2005-04-28 WO claimed
WO-2004074928-A2 PHOTORESIST COMPOSITION FOR DEEP ULTRAVIOLET LITHOGRAPHY AZ ELECTRONIC MATERIALS USA CORP. (US) 2004-09-02 WO claimed
CN-115192470-B Oily composition 宝丽化成工业有限公司 2024-06-18 CN disclosed
CN-113693965-B External preparation for skin for improving wrinkles 宝丽化成工业有限公司 2024-03-29 CN disclosed
US-20240084106-A1 KNEADED MATERIAL, METHOD OF PRODUCING KNEADED MATERIAL, MOLDED BODY, AND OPTICAL MEMBER FUJIFILM CORPORATION (JP) 2024-03-14 US disclosed
US-20240067846-A1 PHOTOPOLYMERIZABLE COMPOSITION, CURED SUBSTANCE, AND OPTICAL MEMBER FUJIFILM CORPORATION (JP) 2024-02-29 US disclosed
CN-117337322-A Kneaded material, method for producing kneaded material, molded body, and optical member 富士胶片株式会社 2024-01-02 CN disclosed
CN-117279959-A Photopolymerizable composition, cured product, and optical member 富士胶片株式会社 2023-12-22 CN disclosed
WO-2023176458-A1 DISINFECTING COMPOSITION CONTAINING THIAZOLE CARBOXYLIC ACID HYDRAZIDE COMPOUND 石原産業株式会社 2023-09-21 WO disclosed
US-20230227424-A1 ULTRAVIOLET ABSORBING AGENT, RESIN COMPOSITION, CURED SUBSTANCE, OPTICAL MEMBER, METHOD OF PRODUCING ULTRAVIOLET ABSORBING AGENT, AND COMPOUND FUJIFILM CORPORATION (JP) 2023-07-20 US disclosed
EP-0206251-B1 HALOACETAMIDE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1988-09-07 EP disclosed
EP-0103278-B1 ANTHRAQUINONE DYES AND THEIR USE BASF Aktiengesellschaft (DE) 1988-06-29 EP disclosed
EP-0242767-A2 N-dihydroindolyl ethyl-sulfon amides BAYER AG (DE) 1987-10-28 EP disclosed
EP-0206251-A1 Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1986-12-30 EP disclosed
US-4614804-A PRINTING, DYEING CELLULOSE BASF AKTIENGESELLSCHAFT (DE) 1986-09-30 US disclosed
EP-0103278-A2 Anthraquinone dyes and their use BASF Aktiengesellschaft (DE) 1984-03-21 EP disclosed
US-4229345-A (2-Chloro-4-cyanophenyl) (4-dialkylaminophenyl)-diazine dye useful for transfer printing BASF AKTIENGESELLSCHAFT (DE) 1980-10-21 US disclosed
US-4136100-A BLUE-VIOLET TO GREEN-BLUE DYEINGS ON CELLULOSE TEXTILES BASF AKTIENGESELLSCHAFT (DE) 1979-01-23 US 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 (2 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-20230227424-A1 ULTRAVIOLET ABSORBING AGENT, RESIN COMPOSITION, CURED SUBSTANCE, OPTICAL MEMBER, METHOD OF PRODUCING ULTRAVIOLET ABSORBING AGENT, AND COMPOUND F12, C9, UNC93B1 ATM 3646/4885TSHR 3613/4885HPGD 1305/4885
US-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation IL4, ARG2, CASP4 ATM 1321/4885TSHR 1759/4885HPGD 1845/4885

“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.