SCHEMBL8616993

SCHEMBL8616993

NC(=O)CCCCN1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.59
GAA P10253 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
KEAP1 Q14145 1/20 0.55
GLA P06280 1/20 0.55
PAOX Q6QHF9 1/20 0.53
LMNA P02545 2/20 0.51
HTR7 P34969 2/20 0.50
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 1/20 0.46
DUSP3 P51452 1/20 0.46
ALDH1A1 P00352 2/20 0.45

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
SCHEMBL30701340 0.98 KDM4E (0.57) KDM4EGAASMN1; SMN2KEAP1GLA
SCHEMBL1726737 0.98 KDM4E (0.57) KDM4EGAASMN1; SMN2KEAP1GLA
SCHEMBL5843494 0.98 KDM4E (0.57) KDM4EGAASMN1; SMN2KEAP1GLA
Hydrochloric Acid SCHEMBL5843429 0.96 GLA (0.56) KDM4EGAASMN1; SMN2KEAP1GLA
SCHEMBL1358701 0.94 KDM4E (0.61) KDM4EGAASMN1; SMN2KEAP1GLA
Hydrochloric Acid SCHEMBL11543248 0.92 GLA (0.60) KDM4EGAASMN1; SMN2KEAP1GLA
SCHEMBL951890 0.88 GLA (0.64) KDM4EGAASMN1; SMN2KEAP1GLA
SCHEMBL30887599 0.86 GLA (0.57) KDM4EGAASMN1; SMN2KEAP1GLA
Hydrochloric Acid SCHEMBL6044162 0.86 GLA (0.68) KDM4EGAASMN1; SMN2KEAP1GLA
SCHEMBL1831207 0.85 EPHX2 (0.53) KDM4EGAASMN1; SMN2KEAP1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2036895-B1 HSP90 INHIBITOR CHUGAI PHARMACEUTICAL CO LTD (JP) 2013-01-16 EP claimed
EP-3801501-A1 ESTROGEN RECEPTOR INHIBITORS AND USES THEROF The Regents of the University of California (US) 2021-04-14 EP disclosed
EP-3224230-A1 ESTROGEN RECEPTOR MODULATORS The Regents of The University of California (US) 2017-10-04 EP disclosed
WO-2016085825-A1 ESTROGEN RECEPTOR MODULATORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-06-02 WO disclosed
EP-0615525-B1 HYDROPHILIC POLY-(N-SUBSTITUTED)ACRYLAMIDE GELS AND THEIR USE IN ELECTROKINETIC AND CHROMATOGRAPHIC METHODOLOGIES RIGHETTI PIER GIORGIO (IT) 1998-05-13 EP disclosed
US-5470916-A Formulations for polyacrylamide matrices in electrokinetic and chromatographic methodologies RIGHETTI PIER G (IT) 1995-11-28 US disclosed
EP-0615525-A1 HYDROPHILIC POLY-(N-SUBSTITUTED)ACRYLAMIDE GELS AND THEIR USE IN ELECTROKINETIC AND CHROMATOGRAPHIC METHODOLOGIES RIGHETTI, Pier Giorgio (IT) 1994-09-21 EP disclosed
WO-1993011174-A1 NEW FORMULATIONS FOR POLYACRYLAMIDE MATRICES IN ELECTROKINETIC AND CHROMATOGRAPHIC METHODOLOGIES RIGHETTI PIER GIORGIO (IT) 1993-06-10 WO disclosed