SCHEMBL31050436

SCHEMBL31050436

NCC(=O)NCCCCCCOC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ACHE P22303 12/20 0.42
FAAH O00519 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PAOX Q6QHF9 2/20 0.37

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
SCHEMBL28340776 0.85 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
SCHEMBL23829960 0.85 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
SCHEMBL29991209 0.85 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
SCHEMBL28969877 0.84 CHRM2 (0.39)
SCHEMBL28531200 0.84 HDAC3 (0.42) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
SCHEMBL28655610 0.83 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2ACHEFAAHMEN1
Hydrochloric Acid SCHEMBL25328852 0.82 CA2 (0.38) ALDH1A1
SCHEMBL14198854 0.82 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2APAOX
SCHEMBL24611784 0.82 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2APAOX
SCHEMBL28099785 0.81 HDAC3 (0.40) ALDH1A1SMN1; SMN2ACHEFAAHMEN1

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
EP-3858385-B1 POLYMER-CONJUGATED METAP2 INHIBITORS, AND THERAPEUTIC METHODS OF USE THEREOF SYNDEVRX INC (US) 2024-09-11 EP disclosed