SCHEMBL28422112

SCHEMBL28422112

O=C=NCC1CCC(C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.50
PLAT P00750 1/20 0.50
LMNA P02545 1/20 0.50
ANPEP P15144 1/20 0.41
ENPEP Q07075 1/20 0.41
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
TSHR P16473 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
GABRA4 P48169 1/20 0.35
GABRE P78334 1/20 0.35
PMP22 Q01453 1/20 0.35
GABRA6 Q16445 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
SCHEMBL3398046 0.84 PLG (0.50) PLGPLATLMNAANPEPENPEP
SCHEMBL3398048 0.84 PLG (0.50) PLGPLATLMNAANPEPENPEP
SCHEMBL1590056 0.82
SCHEMBL19732912 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1081557 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1081546 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL44332 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL2324444 0.76 KMT2A (0.31) KMT2A
SCHEMBL14646010 0.76
SCHEMBL17027507 0.75 MAPT (0.43) LMNAKMT2AMEN1ALDH1A1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112714775-A Heat-curable one-piece composition 3M创新有限公司 2021-04-27 CN disclosed
CN-111868130-A Composition, bonding method and assembly 3M创新有限公司 2020-10-30 CN disclosed
CN-107001286-B Dihydropyrimidine-2-one compounds and medicinal use thereof 日本烟草产业株式会社 2020-07-07 CN disclosed