SCHEMBL6450396

SCHEMBL6450396

C1COC(CCCC2CCCO2)C1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HPGD P15428 3/20 0.42
TP53 P04637 1/20 0.42
ALOX12 P18054 1/20 0.42
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36

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
Hydrochloric Acid SCHEMBL11412369 0.95 EPHX1 (0.46) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL15822139 0.92 EPHX1 (0.48) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL3684347 0.92 EPHX1 (0.60) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL13294283 0.92 EPHX1 (0.60) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL11412372 0.91 EPHX1 (0.43) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL7152245 0.89 EPHX1 (0.42) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL2002222 0.88 EPHX1 (0.42) EPHX1LMNAPOLBUSP2SMN1; SMN2
SCHEMBL1493226 0.85
SCHEMBL3523999 0.85
SCHEMBL11356598 0.85 EPHX1 (0.43) EPHX1LMNAPOLBUSP2SMN1; SMN2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1525235-A1 MICROSTRUCTURE CHAIN TRANSFER AGENTS FOR ANIONIC POLYMERIZATION Hellermann, Walter (DE) 2005-04-27 EP claimed
WO-2004014966-A1 MICROSTRUCTURE CHAIN TRANSFER AGENTS FOR ANIONIC POLYMERIZATION HELLERMANN WALTER (DE) 2004-02-19 WO claimed
CN-101657475-B Carboxylate terminated polymer and the purposes in impact-modified plastics thereof BRIDGESTONE CO.,LTD. (JP) 2016-02-17 CN disclosed
EP-1252211-B1 COPOLYMERS PREPARED BY USING BOTH ANIONIC POLYMERIZATION TECHNIQUES AND COORDINATION CATALYSTS BRIDGESTONE CORP (JP) 2013-07-24 EP disclosed
CN-101657475-A Carboxylate terminated polymers and their use in impact-modified plastics BRIDGESTONE CORP US 2010-02-24 CN disclosed
EP-1525235-A1 MICROSTRUCTURE CHAIN TRANSFER AGENTS FOR ANIONIC POLYMERIZATION Hellermann, Walter (DE) 2005-04-27 EP disclosed
US-6765066-B2 MODIFYING LIVING POLYMER BY REACTING WITH ALKYL METAL HALIDE, REACTING INTERMEDIATE WITH CONJUGATED DIENE MONOMER BRIDGESTONE CORPORATION (JP) 2004-07-20 US disclosed
WO-2004014966-A1 MICROSTRUCTURE CHAIN TRANSFER AGENTS FOR ANIONIC POLYMERIZATION HELLERMANN WALTER (DE) 2004-02-19 WO disclosed
EP-1252211-A1 COPOLYMERS PREPARED BY USING BOTH ANIONIC POLYMERIZATION TECHNIQUES AND COORDINATION CATALYSTS Bridgestone Corporation (JP) 2002-10-30 EP disclosed
WO-2001049764-A1 COPOLYMERS PREPARED BY USING BOTH ANIONIC POLYMERIZATION TECHNIQUES AND COORDINATION CATALYSTS BRIDGESTONE CORPORATION (JP) 2001-07-12 WO disclosed