SCHEMBL56520

SCHEMBL56520

OCCc1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.59
TAAR1 Q96RJ0 3/20 0.56
TDP1 Q9NUW8 1/20 0.55
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
MAOB P27338 2/20 0.48
IDO1 P14902 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.48
AOC3 Q16853 2/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 1/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL10787556 0.93 CA2 (0.52) CA2TAAR1TDP1PTGS1PTGS2
SCHEMBL6546 0.93 MAOB (0.59) CA2TAAR1TDP1PTGS1PTGS2
SCHEMBL11129547 0.89 CA2 (0.48) CA2TAAR1TDP1PTGS1PTGS2
SCHEMBL9107231 0.87 LTA4H (0.51) CA2TAAR1TDP1MAOBKDM4E
SCHEMBL40656 0.85 CA2 (0.77) CA2TAAR1TDP1CA12CA1
SCHEMBL4228481 0.85 CA2 (0.50) CA2TAAR1TDP1PTGS1PTGS2
SCHEMBL79192 0.84 TAAR1 (0.52) CA2TAAR1PTGS1PTGS2MAOB
SCHEMBL1287204 0.82 CA2 (0.52) CA2TAAR1PTGS1PTGS2MAOB
SCHEMBL6057959 0.82 CA2 (0.72) CA2TDP1CA12CA1CA4
SCHEMBL7437052 0.82 TAAR1 (0.68) TAAR1PTGS1PTGS2MAOBIDO1

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 1223 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119491240-A Method for preparing benzyl carboxylic acid compound by taking carbon dioxide as raw material 哈尔滨工业大学(深圳) 2025-02-21 CN claimed
CN-119409729-A Method for preparing S- (1H-pyrrole-2-yl) substituted phosphorothioate compound 岳阳凯茂化工材料有限公司 2025-02-11 CN claimed
CN-118812368-A Method for preparing amine compound by reductive amination of alcohol compound 中国科学院大连化学物理研究所 2024-10-22 CN claimed
CN-115369432-B Method for preparing nitrile by electrocatalytic coupling of primary alcohol and ammonia substance 大连理工大学 2024-08-20 CN claimed
EP-3664213-B1 ELECTROLYTE FOR LITHIUM METAL BATTERY AND LITHIUM METAL BATTERY COMPRISING SAME LG ENERGY SOLUTION LTD (KR) 2023-09-13 EP claimed
EP-3547414-B1 LITHIUM ELECTRODE AND LITHIUM SECONDARY BATTERY COMPRISING SAME LG ENERGY SOLUTION LTD (KR) 2023-09-13 EP claimed
CN-115772141-A Synthetic method of aryl-containing piperidine derivative Boc piperidine 4-fluorophenylethanol 苏州汉德创宏生化科技有限公司 2023-03-10 CN claimed
CN-115369432-A Method for preparing nitrile by coupling electro-catalysis of primary alcohol and ammonia substances 大连理工大学 2022-11-22 CN claimed
US-11495824-B2 Electrolyte for lithium metal battery and lithium metal battery comprising same LG ENERGY SOLUTION, LTD. (KR) 2022-11-08 US claimed
CN-110192294-B Lithium electrode and lithium secondary battery comprising same 株式会社LG新能源 2022-09-20 CN claimed
WO-2006087538-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2006-08-24 WO claimed
JP-2006510736-A 2006-03-30 JP claimed
US-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US claimed
US-20060004123-A1 PHASE CHANGE INK PRINTING PROCESS XEROX CORPORATION 2006-01-05 US claimed
WO-2005112640-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT AND PROPHYLAXIS OF HEPATITIS C VIRAL INFECTIONS AND ASSOCIATED DISEASES VIROPHARMA INCORPORATED (US) 2005-12-01 WO claimed
EP-1581207-A2 BENZOFURAN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT AND PROPHYLAXIS OF HEPATITIS C VIRAL INFECTIONS AND ASSOCIATED DISEASES Viropharma Incorporated (US) 2005-10-05 EP claimed
WO-2004041201-A2 BENZOFURAN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT AND PROPHYLAXIS OF HEPATITIS C VIRAL INFECTIONS AND ASSOCIATED DISEASES VIROPHARMA INCORPORATED (US) 2004-05-21 WO claimed
US-6613317-B1 In particular northern corn rootworm THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2003-09-02 US claimed
EP-0443560-A2 HIV protease inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1991-08-28 EP claimed
EP-0443573-A2 HIV protease inhibitors containing derived amino acids BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1991-08-28 EP claimed