SCHEMBL341114

SCHEMBL341114

O=C(O)COc1cccs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
CD69 Q07108 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
CYP2C9 P11712 1/20 0.47
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
GLA P06280 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
DAO P14920 1/20 0.42
PTPN7 P35236 2/20 0.42
FFAR1 O14842 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
PTPN12 Q05209 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
SCHEMBL8121229 0.86 ALOX15 (0.50) ALOX15SMN1; SMN2POLBKMT2AKDM4E
SCHEMBL707494 0.84 KDM4E (0.44) SMN1; SMN2POLBKMT2AKDM4EHPGD
SCHEMBL11008232 0.82 KMT2A (0.39) SMN1; SMN2POLBKMT2AHPGDDAO
SCHEMBL724289 0.82 GSK3B (0.40) POLBCYP2C9KMT2AHPGDCYP2C19
Potassium Ion SCHEMBL11800653 0.81 HPGD (0.37) POLBCYP2C9KMT2AHPGDCYP2C19
SCHEMBL1418443 0.81 LMNA (0.50) SMN1; SMN2POLBKMT2AKDM4EHPGD
SCHEMBL891160 0.81 MMP1 (0.44) POLBKMT2AKDM4EHPGDCYP1A2
SCHEMBL5759533 0.80 L3MBTL1 (0.39) SMN1; SMN2POLBCYP2C9KMT2AHPGD
SCHEMBL8814468 0.79 KMT2A (0.51) SMN1; SMN2KMT2AKDM4EHPGDCYP1A2
SCHEMBL5000541 0.79 HPGD (0.51) SMN1; SMN2POLBKMT2AHPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102639531-B The anhydrate of tiotropium bromide GENERICS [UK] LTD. (GB) 2016-01-20 CN claimed
CN-101979391-B Method for preparing tiotropium bromide JINAN DEXINJIA BIO & TECH CO LTD 2013-06-05 CN claimed
CN-101768158-B Tiotropium bromide anhydride and preparation method thereof NANCHANG HELIOEAST SCIENCE AND TECHNOLOGY CO LTD 2013-05-29 CN claimed
CN-102639531-A Anhydrate of triotropium bromide GENERICS UK LTD 2012-08-15 CN claimed
CN-101979391-A Method for preparing tiotropium bromide JINAN DEXINJIA BIO & TECH CO LTD 2011-02-23 CN claimed
US-20100280113-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS TRUSTEES OF BOSTON UNIVERSITY (US) 2010-11-04 US claimed
CN-101768158-A Tiotropium bromide anhydride and preparation method thereof NANCHANG HELIOEAST SCIENCE & TECHNOLOGY CO LTD 2010-07-07 CN claimed
CN-101230063-B Method for preparing tiotropium bromide HONGYI SCIENCE AND TECHNOLOGY CO LTD NANCHANG 2010-06-02 CN claimed
CN-101230063-A Method for preparing tiotropium bromide HONGYI SCIENCE AND TECHNOLOGY (CN) 2008-07-30 CN claimed
US-20080027136-A1 Compositions and methods for the treatment of cystic fibrosis UNIVERSITY OF WASHINGTON 2008-01-31 US claimed
WO-1995011699-A1 PHYSIOLOGICALLY STABLE COMPOSITIONS OF BUTYRIC ACID, AND BUTYRIC ACID SALTS AND DERIVATIVES AS ANTI-NEOPLASTIC AGENTS THE TRUSTEES OF BOSTON UNIVERSITY (US) 1995-05-04 WO claimed
US-5322910-A Catalyst system of nickel compound and aromatic carboxylic acid PHILLIPS PETROLEUM COMPANY (US) 1994-06-21 US claimed
US-5272124-A Ethylene polymerization catalyst comprising a nickel compound and an aromatic carboxylic acid compound PHILLIPS PETROLEUM COMPANY (US) 1993-12-21 US claimed
EP-0276016-B1 PHOTOPOLYMERIZABLE COMPOSITION Nippon Paint Co., Ltd. (JP) 1992-08-12 EP claimed
EP-0284892-B1 THIENYLOXYACETIC ACID DERIVATIVES, A PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CL PHARMA AKTIENGESELLSCHAFT (AT) 1990-10-31 EP claimed
US-4965171-A POLYMERIZABLE, ETHYLENICALLY UNSATURATED COMPONENT WITH PHOTOINITIATOR OF COUMARIN DYE, DIARYLIODONIUM SALT AND AMINE OR THIOPHENOXYACETIC ACID NIPPON PAINT CO., LTD. (JP) 1990-10-23 US claimed
US-4946761-A POLYMER CONTAINING CARBOXYL END GROUPS FUJI PHOTO FILM CO., LTD. (JP) 1990-08-07 US claimed
US-4868092-A SENSITIVE TO VISIBLE LIGHT, XANTHENE DYE INITIATOR NIPPON PAINT CO., LTD. (JP) 1989-09-19 US claimed
EP-0276016-A2 Photopolymerizable composition Nippon Paint Co., Ltd. (JP) 1988-07-27 EP claimed
US-4436596-A N-Substituted-2-(R)-(sulfinic acid)-3-(S)-(acylamido)-4-oxo-azetidines and process ELI LILLY AND COMPANY (US) 1984-03-13 US claimed