SCHEMBL25816699

SCHEMBL25816699

CCC(=O)NCCCOCCN(C)CCOCCCNC(=O)CC

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
RECQL P46063 2/20 0.47
ACHE P22303 1/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 1/20 0.39
DNM1 Q05193 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL25816572 0.89 MEN1 (0.47) MEN1KMT2ARECQLACHEDNM1
SCHEMBL25816703 0.89 MEN1 (0.53) MEN1KMT2ARECQLACHEDNM1
SCHEMBL23945661 0.80 MEN1 (0.59) MEN1KMT2ARECQLACHETSHR
SCHEMBL15046976 0.80 MEN1 (0.59) MEN1KMT2ARECQLTSHRALDH1A1
SCHEMBL14289047 0.80 MEN1 (0.59) MEN1KMT2ARECQLTSHRALDH1A1
SCHEMBL12519763 0.80 MEN1 (0.59) MEN1KMT2ARECQLACHETSHR
SCHEMBL15942670 0.80 MEN1 (0.59) MEN1KMT2ARECQLTSHRALDH1A1
SCHEMBL13597756 0.80 MEN1 (0.64) MEN1KMT2ARECQLTSHRALDH1A1
SCHEMBL25816679 0.80 MEN1 (0.71) MEN1KMT2ARECQLALDH1A1DNM1
SCHEMBL5597036 0.79 MEN1 (0.57) MEN1KMT2ARECQLTSHRALDH1A1

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-2023125806-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTIONS AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2023-07-06 WO disclosed