SCHEMBL985272

SCHEMBL985272

CC(=O)c1ccc(O)c(Br)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.55
ESR1 P03372 1/20 0.51
HTT P42858 1/20 0.49
ALOX15 P16050 1/20 0.48
POLB P06746 1/20 0.47
HSD17B1 P14061 3/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MAPT P10636 2/20 0.44
MKNK2 Q9HBH9 1/20 0.43
CA5A P35218 1/20 0.43
CYP2A6 P11509 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL9649870 0.84 HSD17B1 (0.62) PKMESR1ALOX15HSD17B1NPC1
SCHEMBL10034774 0.83 PKM (0.50) PKMHTTPOLBHSD17B1NPC1
SCHEMBL29748630 0.82 ALDH1A1 (0.53) PKMESR1HTTALOX15POLB
SCHEMBL3022646 0.82 MAPT (0.47) PKMHSD17B1NPC1RAB9ASMN1; SMN2
SCHEMBL30436340 0.80 CA12 (0.64) ESR1HTTALOX15POLBSMN1; SMN2
SCHEMBL312791 0.80 CA12 (0.64) ESR1HTTALOX15POLBSMN1; SMN2
SCHEMBL31098180 0.79 CA12 (0.62) PKMHTTPOLBHSD17B1NPC1
SCHEMBL144106 0.79 CA12 (0.62) PKMHTTPOLBHSD17B1NPC1
SCHEMBL407154 0.78 RAB9A (0.67) NPC1RAB9ASMN1; SMN2MAPTCYP2A6
SCHEMBL4900937 0.78 ALOX15 (0.48) ESR1ALOX15POLBCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119569601-A Preparation method and application for efficiently preparing arformoterol tartrate intermediate 江苏长泰药业股份有限公司 2025-03-07 CN claimed
US-4868257-A Process for the production of 3-mono or 3,5 disubstituted-4-acetoxystyrene, its polymerization HOECHST CELANESE CORPORATION (US) 1989-09-19 US claimed
US-4868256-A Process for the production of 3-mono or 3,5-disubstituted-4-acetoxystyrene its polymerization, and hydrolysis HOECHST CELANESE (US) 1989-09-19 US claimed
CN-119569601-A Preparation method and application for efficiently preparing arformoterol tartrate intermediate 江苏长泰药业股份有限公司 2025-03-07 CN disclosed
CN-107324975-B Direct hydroxylation or amination method of photocatalytic benzene and derivatives thereof 中国科学院理化技术研究所 2020-11-24 CN disclosed
EP-2940012-B1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF SUMITOMO CHEMICAL CO (JP) 2019-01-30 EP disclosed
EP-2940012-B1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF SUMITOMO CHEMICAL CO (JP) 2019-01-30 EP disclosed
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
EP-2937344-B1 PYRIDINYL- AND PYRAZINYL -METHYLOXY - ARYL DERIVATIVES USEFUL AS INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) GLAXO GROUP LTD (GB) 2017-08-23 EP disclosed
WO-1995011680-A1 HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-05-04 WO disclosed
US-5364866-A Side effect reduction HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1994-11-15 US disclosed
EP-0612318-A1 HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-08-31 EP disclosed
EP-0542136-A1 Heteroarylpiperidines, pyrrolidines and piperazines and their use as antipsychotics and analgetics HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-05-19 EP disclosed
WO-1993009102-A1 HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1993-05-13 WO disclosed
EP-0267670-B1 OPTICALLY ACTIVE LIQUID CRYSTAL COMPOUND HAVING CYANO GROUP Chisso Corporation (JP) 1992-12-23 EP disclosed
EP-0402644-A1 N-(aryloxyalkyl)heteroarylpiperidines and -heteroarylpiperazines,a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1990-12-19 EP disclosed
US-4886622-A Optically active liquid crystal compound having cyano group CHISSO CORPORATION (JP) 1989-12-12 US disclosed
EP-0267670-A1 Optically active liquid crystal compound having cyano group Chisso Corporation (JP) 1988-05-18 EP disclosed