SCHEMBL23925262

SCHEMBL23925262

C#CCNC(=O)NNC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPK1 P28482 1/20 0.43
APLNR P35414 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
GAA P10253 3/20 0.38
CTSS P25774 2/20 0.36
CTSK P43235 2/20 0.36
EPHX1 P07099 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL16913 0.83 TDP1 (0.48) MEN1KMT2ATDP1GAACTSS
SCHEMBL11525177 0.80 MEN1 (0.56) LMNAPOLBMEN1KMT2AMAPK1
SCHEMBL15289984 0.79 APLNR (0.42) LMNAPOLBMEN1KMT2AMAPK1
SCHEMBL25605409 0.76 APLNR (0.44) LMNAPOLBMEN1KMT2AMAPK1
SCHEMBL284141 0.76 APLNR (0.55) LMNAPOLBMEN1KMT2AMAPK1
SCHEMBL15792091 0.75 LMNA (0.49) LMNAPOLBMEN1KMT2AMAPK1
Dimethyl Sulfoxide SCHEMBL21174539 0.75 TDP1 (0.42) MEN1KMT2ATDP1GAACTSS
SCHEMBL10258326 0.75 TDP1 (0.42) MEN1KMT2AAPLNRTDP1GAA
SCHEMBL14560922 0.75 MEN1 (0.40) LMNAPOLBMEN1KMT2AMAPK1
Benzene SCHEMBL11623845 0.74 LMNA (0.48) LMNAPOLBMEN1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174965-A1 METHODS AND PRODUCTS UNIV BIRMINGHAM (GB) 2023-06-08 US disclosed
US-20230174965-A1 METHODS AND PRODUCTS UNIV BIRMINGHAM (GB) 2023-06-08 US disclosed
US-20230174965-A1 METHODS AND PRODUCTS UNIV BIRMINGHAM (GB) 2023-06-08 US disclosed
EP-4136223-A2 METHODS AND PRODUCTS The University Of Birmingham (GB) 2023-02-22 EP disclosed
WO-2021209765-A2 METHODS AND PRODUCTS THE UNIVERSITY OF BIRMINGHAM (GB) 2021-10-21 WO disclosed