SCHEMBL24920288

SCHEMBL24920288

NCCOCCOCCOCCOCCC(=O)NCCCNC(=O)CN(CCNC(=O)CN(CCN)CCN)CCNC(=O)CN(CCN)CCN

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 8/20 0.34
CA2 P00918 8/20 0.34
PLK1 P53350 2/20 0.33
TSHR P16473 1/20 0.33
KDM4A O75164 1/20 0.33
HIF1A Q16665 1/20 0.33
TET2 Q6N021 1/20 0.33
DOHH Q9BU89 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
DNM1 Q05193 2/20 0.31

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
SCHEMBL24920286 0.97 CA1 (0.36) CA1CA2PLK1TSHRKDM4A
SCHEMBL24778330 0.89 CA2 (0.33) CA1CA2PLK1TSHRKDM4A
SCHEMBL24920230 0.86 TDP1 (0.39) CA1CA2PLK1GAA
SCHEMBL24920287 0.86 CA1 (0.30) CA1CA2
SCHEMBL24920231 0.86 TDP1 (0.39) CA1CA2PLK1GAA
SCHEMBL31114320 0.85 CA2 (0.35) CA1CA2PLK1TSHRKDM4A
SCHEMBL24920285 0.83 CA1 (0.31) CA1CA2
SCHEMBL24920638 0.82 PLK1 (0.30) PLK1
SCHEMBL24920309 0.79 TSHR (0.43) CA1CA2PLK1TSHRKDM4A
SCHEMBL12341831 0.79 TSHR (0.47) CA1CA2PLK1TSHRSMN1; SMN2

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
WO-2023006782-A1 CONJUGATING REAGENTS AND CONJUGATES THEREOF CAMBRIDGE ENTERPRISE LIMITED (GB) 2023-02-02 WO disclosed