SCHEMBL23052899

SCHEMBL23052899

CCCCN(C(C)=O)C(C)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 1/20 0.42
ZDHHC7 Q9NXF8 1/20 0.40
ALDH1A1 P00352 2/20 0.35
ABCB1 P08183 1/20 0.35
DNM1 Q05193 1/20 0.34
MAPT P10636 2/20 0.34
HSD17B10 Q99714 1/20 0.34
BIRC2 Q13490 2/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
ATM Q13315 1/20 0.33
KDM5A P29375 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
MCL1 Q07820 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL2995967 0.86 ALDH1A1 (0.35) CA1ALDH1A1DNM1MAPTHSD17B10
SCHEMBL13165157 0.81 CA1 (0.44) CA1CA2ZDHHC7ALDH1A1ABCB1
SCHEMBL23052900 0.81 TSHR (0.45) ALDH1A1DNM1ATM
SCHEMBL20126073 0.80 TSHR (0.39) CA1CA2ZDHHC7ALDH1A1ABCB1
SCHEMBL25337703 0.79 CA1 (0.46) CA1CA2ZDHHC7ALDH1A1ABCB1
SCHEMBL715425 0.79 CA12 (0.36) CA1CA2ALDH1A1MAPTCA12
SCHEMBL30859297 0.79 CA12 (0.36) CA1CA2ALDH1A1MAPTCA12
SCHEMBL27650727 0.79 EPHX2 (0.40) DNM1MAPTATMKDM5AKDM4C
SCHEMBL498398 0.77 EPHX2 (0.41) CA1ALDH1A1CA12CA9KDM5A
SCHEMBL5393967 0.76 ZDHHC7 (0.44) CA1CA2ZDHHC7ABCB1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210061929-A1 ACTIVE-ENERGY-RAY-CURABLE COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE INK, COMPOSITION STORED CONTAINER, TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING METHOD AND APPARATUS, CURED PRODUCT, AND DECORATED PRODUCT RICOH COMPANY, LTD. (JP) 2021-03-04 US disclosed