SCHEMBL25817165

SCHEMBL25817165

CCC(=O)NCCCCCN(C)CCCCCNC(=O)CC

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
DNM1 Q05193 2/20 0.47
CASP2 P42575 1/20 0.47
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NAAA Q02083 1/20 0.44
EPHX1 P07099 4/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
RECQL P46063 1/20 0.41
FAAH O00519 1/20 0.41
KDM5A P29375 2/20 0.40
KDM4C Q9H3R0 2/20 0.40
PHF8 Q9UPP1 1/20 0.40

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
SCHEMBL25816679 0.98 MEN1 (0.71) MEN1KMT2ADNM1CASP2ALDH1A1
SCHEMBL25816837 0.96 MEN1 (0.68) MEN1KMT2ADNM1CASP2ALDH1A1
SCHEMBL19570491 0.92 MEN1 (0.63) MEN1KMT2ADNM1CASP2NAAA
SCHEMBL16384405 0.88 MEN1 (0.68) MEN1KMT2ADNM1CASP2ALDH1A1
SCHEMBL25751510 0.86 MEN1 (0.71) MEN1KMT2ADNM1CASP2ALDH1A1
SCHEMBL9259257 0.85 MEN1 (0.94) MEN1KMT2ACASP2ALDH1A1SMN1; SMN2
SCHEMBL21765846 0.85 MEN1 (0.94) MEN1KMT2ACASP2ALDH1A1SMN1; SMN2
SCHEMBL11758762 0.85 MEN1 (0.94) MEN1KMT2ACASP2ALDH1A1SMN1; SMN2
SCHEMBL25816703 0.85 MEN1 (0.53) MEN1KMT2ADNM1CASP2RECQL
SCHEMBL27450160 0.84 DNM1 (0.65) MEN1KMT2ADNM1CASP2KDM4E

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