SCHEMBL24368593

SCHEMBL24368593

CC(N)(C#N)CCC(=O)NCCCN

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.38
TSHR P16473 1/20 0.38
KDM4A O75164 1/20 0.36
HIF1A Q16665 1/20 0.36
TET2 Q6N021 1/20 0.36
DOHH Q9BU89 1/20 0.36
PAOX Q6QHF9 3/20 0.36
CASP2 P42575 1/20 0.35
HDAC6 Q9UBN7 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NAAA Q02083 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL24979274 0.85 SLC6A5 (0.37) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL22569944 0.83 PAOX (0.30) PAOX
SCHEMBL16248720 0.80 SLC6A5 (0.44) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL21162680 0.78 DNM1 (0.36) TSHRKDM4AHIF1ATET2DOHH
SCHEMBL21162679 0.78 HIF1A (0.41) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL24976058 0.76 SLC6A5 (0.41) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL27176325 0.73 SLC6A5 (0.49) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL24761185 0.71 SLC6A5 (0.51) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL6745342 0.71 TSHR (0.54) SLC6A5TSHRKDM4AHIF1ATET2
SCHEMBL5493471 0.71 SLC6A5 (0.47) SLC6A5TSHRKDM4AHIF1ATET2

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-2022086853-A1 STAR POLYMER DRUG CONJUGATES AVIDEA TECHNOLOGIES, INC. (US) 2022-04-28 WO disclosed