SCHEMBL4845826

SCHEMBL4845826

CC(=CCCOCCN1CC1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 4/20 0.38
TDP1 Q9NUW8 2/20 0.38
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTR1A P08908 1/20 0.35
HTR1B P28222 1/20 0.35

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
SCHEMBL15535508 0.84 CD81 (0.39) KDM4E
SCHEMBL1285651 0.82 PAOX (0.42) MEN1KMT2AKDM4EALDH1A1RAB9A
SCHEMBL504158 0.82 CD81 (0.39) ALDH1A1RAB9ALMNA
SCHEMBL5682570 0.82 CD81 (0.39) ALDH1A1RAB9ALMNA
SCHEMBL6851328 0.82 CD81 (0.38) ALDH1A1
SCHEMBL6851323 0.82 CD81 (0.38) ALDH1A1
SCHEMBL1285998 0.81 PAOX (0.44) MEN1KMT2AKDM4EALDH1A1RAB9A
SCHEMBL1285641 0.79 PAOX (0.47) MEN1KMT2AKDM4EALDH1A1TDP1
SCHEMBL1286052 0.79 PAOX (0.47) MEN1KMT2AKDM4EALDH1A1TDP1
SCHEMBL4834215 0.77 ACHE (0.36) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2675783-B1 ADDITION-FRAGMENTATION AGENTS 3M INNOVATIVE PROPERTIES CO (US) 2020-04-22 EP disclosed
US-9403966-B2 Addition-fragmentation agents 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-08-02 US disclosed
US-20150203658-A1 ADDITION-FRAGMENTATION AGENTS SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2015-07-23 US disclosed
US-8980969-B2 Addition-fragmentation agents 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-03-17 US disclosed
US-7384984-B2 Reactive hydrophilic oligomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-06-10 US disclosed
US-7074858-B2 Reactive oligomers HEILMANN STEVEN M 2006-07-11 US disclosed
US-7015286-B2 Reactive oligomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-21 US disclosed
US-20050131148-A1 Reactive hydrophilic oligomers 3M INNOVATIVE PROPERTIES COMPANY 2005-06-16 US disclosed
US-20030212210-A1 Reactive oligomers 3M INNOVATIVE PROPERTIES COMPANY 2003-11-13 US disclosed