SCHEMBL920394

SCHEMBL920394

CC(CO)CCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HPGD P15428 1/20 0.47
OPRK1 P41145 1/20 0.46
KDM4E B2RXH2 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
POLB P06746 1/20 0.44
ANPEP P15144 1/20 0.44
ERAP1 Q9NZ08 1/20 0.44

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
SCHEMBL16429330 1.00 TRPA1 (0.50) TRPA1TDP1TSHRMEN1HTT
SCHEMBL111796 0.88 TRPA1 (0.47) TRPA1TDP1KMT2ASMN1; SMN2HPGD
SCHEMBL4785593 0.86 TSHR (0.52) TSHRMEN1HTTKMT2ASMN1; SMN2
SCHEMBL28973918 0.86 SIGMAR1 (0.46) TRPA1TDP1KMT2AHPGDCYP2C9
SCHEMBL112994 0.85 TDP1 (0.54) TRPA1TDP1TSHRMEN1HTT
SCHEMBL27498397 0.85 TDP1 (0.54) TRPA1TDP1TSHRMEN1HTT
SCHEMBL26606263 0.85 TDP1 (0.54) TRPA1TDP1TSHRMEN1HTT
SCHEMBL17027762 0.84 TRPA1 (0.47) TRPA1
SCHEMBL17027833 0.84 TRPA1 (0.47) TRPA1
SCHEMBL4557581 0.84 TRPA1 (0.47) TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344244-A Preparation method of deuterated compound based on alkyl alcohol 大连理工大学 2024-07-16 CN disclosed
CN-110392601-A Electret sheet material and filter 优泊公司 2019-10-29 CN disclosed
EP-2800559-B1 AGENT FOR REDUCTION OF SENSORY IRRITATION KAO CORP (JP) 2018-09-05 EP disclosed
CN-108473484-A Compounds useful as TRPM8 modulators 赛诺米克斯公司 2018-08-31 CN disclosed
EP-2351572-B1 AGENT HAVING ANTI-HELICOBACTER PYLORI ACTIVITY JAPAN ROYAL JELLY CO LTD (JP) 2018-05-16 EP disclosed
US-9856196-B2 Agent for reduction of sensory irritation KAO CORPORATION (JP) 2018-01-02 US disclosed
US-9856196-B2 Agent for reduction of sensory irritation KAO CORPORATION (JP) 2018-01-02 US disclosed
US-9505783-B2 Method of producing pyrone and pyridone derivatives SHIONOGI & CO., LTD. (JP) 2016-11-29 US disclosed
CN-104039315-B For reducing the preparation of sensory stimuli 花王株式会社 2016-08-24 CN disclosed
CN-105856708-A ELECTROSTATIC ADSORBABLE SHEET 优泊公司 2016-08-17 CN disclosed
CN-102215852-A Agent having anti-helicobacter pylori activity UNIV RYUKYUS 2011-10-12 CN disclosed
US-20110206791-A1 AGENT HAVING ANTI-HELICOBACTER PYLORI ACTIVITY JAPAN ROYAL JELLY CO., LTD. (JP) 2011-08-25 US disclosed
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2351572-A1 AGENT HAVING ANTI-HELICOBACTER PYLORI ACTIVITY University of The Ryukyus (JP) 2011-08-03 EP disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
CN-102066103-A Electrostatic absorption sheet YUPO CORP 2011-05-18 CN disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
WO-2010110409-A1 PROCESS FOR PRODUCING PYRONE AND PYRIDONE DERIVATIVES 塩野義製薬株式会社 (JP) 2010-09-30 WO disclosed
US-20100041694-A1 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENIC MICROBES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-18 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 (3 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-20100041694-A1 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENIC MICROBES HDHD5, NAAA, BROX TRPA1 1996/4885TDP1 3566/4885TSHR 4380/4885
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 TRPA1 1073/4885TDP1 4034/4885TSHR 2588/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 TRPA1 1192/4885TDP1 3862/4885TSHR 2777/4885

“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.