SCHEMBL9547176

SCHEMBL9547176

[CH2]C(=O)NCC[N+](C)(C)CCO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.38
APAF1 O14727 1/20 0.35
POLB P06746 1/20 0.35
GRK2 P25098 1/20 0.35
DNMT1 P26358 1/20 0.35
PTPN7 P35236 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
PPP1CA P62136 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
PTPN22 Q9Y2R2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP3A4 P08684 1/20 0.32
SLC5A7 Q9GZV3 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
PSMD14 O00487 1/20 0.30

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
SCHEMBL9547184 0.81 KDM4E (0.44) DNM1APAF1POLBGRK2DNMT1
SCHEMBL23691239 0.76 KMT2A (0.38) DNM1APAF1POLBGRK2DNMT1
SCHEMBL209977 0.71
Iodide SCHEMBL9547221 0.71 MCL1 (0.53) DNM1APAF1POLBGRK2DNMT1
SCHEMBL187428 0.71
SCHEMBL10415439 0.71 DNM1 (0.60) DNM1APAF1POLBGRK2DNMT1
SCHEMBL14448326 0.70 KDM4E (0.52) BCHEACHE
SCHEMBL12800343 0.70 DNM1 (0.44) DNM1APAF1POLBGRK2DNMT1
SCHEMBL10786698 0.70 ACHE (0.43) MEN1LMNAKMT2AACHE
SCHEMBL23553592 0.69 KDM4E (0.52) DNM1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993023402-A1 3-AZETIDINYLTHIO-CARBAPENEME DERIVATIVES, THEIR PREPARATION AND USE AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-25 WO claimed
WO-1993023402-A1 3-AZETIDINYLTHIO-CARBAPENEME DERIVATIVES, THEIR PREPARATION AND USE AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-25 WO disclosed