SCHEMBL23054352

SCHEMBL23054352

CNCCCC(NC(=O)C(CCCNC)NC(=O)C(CCCNC)NC)C(C)=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 1/20 0.49
SIRT5 Q9NXA8 2/20 0.36
GNPAT O15228 2/20 0.34
SIRT6 Q8N6T7 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
NMT2 O60551 1/20 0.32
NMT1 P30419 1/20 0.32
MMP1 P03956 2/20 0.30
MMP3 P08254 2/20 0.30
MMP9 P14780 2/20 0.30
CACNA1B Q00975 1/20 0.30
HTR2A P28223 1/20 0.30
HRH1 P35367 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
SCHEMBL21626605 1.00 KISS1R (0.49) KISS1RSIRT5GNPATSIRT6SIRT1
SCHEMBL24155382 0.93 KISS1R (0.45) KISS1RSIRT5GNPATSIRT6SIRT1
SCHEMBL24155383 0.93 KISS1R (0.45) KISS1RSIRT5GNPATSIRT6SIRT1
SCHEMBL24155380 0.93 KISS1R (0.45) KISS1RSIRT5GNPATSIRT6SIRT1
SCHEMBL16221913 0.93 KISS1R (0.45) KISS1RSIRT5GNPATSIRT6SIRT1
SCHEMBL19035531 0.87 SIRT6 (0.45) KISS1RSIRT5SIRT6SIRT1MMP1
SCHEMBL18291772 0.87 SIRT6 (0.45) KISS1RSIRT5SIRT6SIRT1NMT2
SCHEMBL24155387 0.86 KISS1R (0.40) KISS1RSIRT5GNPATSIRT6SIRT1
SCHEMBL13366903 0.85 KISS1R (0.53) KISS1RCACNA1BHTR2AHRH1
SCHEMBL14525182 0.85 KISS1R (0.53) KISS1RCACNA1BHTR2AHRH1

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-2021035310-A1 TARGETED DENDRIMER CONJUGATES STARPHARMA PTY LTD (AU) 2021-03-04 WO disclosed