SCHEMBL25816837

SCHEMBL25816837

CCC(=O)NCCCCN(C)CCCNC(=O)CC

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
DNM1 Q05193 2/20 0.47
NAAA Q02083 1/20 0.44
CASP2 P42575 1/20 0.42
RECQL P46063 1/20 0.41
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.39
ACKR3 P25106 1/20 0.39
USP2 O75604 1/20 0.39

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) MEN1KMT2ADNM1NAAACASP2
SCHEMBL25817165 0.96 MEN1 (0.68) MEN1KMT2ADNM1NAAACASP2
SCHEMBL19570491 0.92 MEN1 (0.63) MEN1KMT2ADNM1NAAACASP2
SCHEMBL25751510 0.86 MEN1 (0.71) MEN1KMT2ADNM1NAAACASP2
SCHEMBL25816703 0.85 MEN1 (0.53) MEN1KMT2ADNM1CASP2RECQL
SCHEMBL25816840 0.85 CASP2 (0.63) MEN1KMT2ADNM1NAAACASP2
SCHEMBL16384405 0.84 MEN1 (0.68) MEN1KMT2ADNM1NAAACASP2
SCHEMBL11567494 0.84 MEN1 (0.52) MEN1KMT2ADNM1NAAACASP2
SCHEMBL7159679 0.83 MEN1 (0.67) MEN1KMT2ADNM1NAAARECQL
SCHEMBL16316426 0.83 MEN1 (0.58) MEN1KMT2ADNM1RECQLALDH1A1

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