SCHEMBL25816703

SCHEMBL25816703

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

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
RECQL P46063 1/20 0.41
DNM1 Q05193 1/20 0.36
ACHE P22303 2/20 0.36
CASP2 P42575 1/20 0.35
DRD3 P35462 1/20 0.34

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 0.92 MEN1 (0.47) MEN1KMT2ARECQLDNM1ACHE
SCHEMBL25816699 0.89 MEN1 (0.53) MEN1KMT2ARECQLDNM1ACHE
SCHEMBL25816679 0.87 MEN1 (0.71) MEN1KMT2ARECQLDNM1CASP2
SCHEMBL25817165 0.85 MEN1 (0.68) MEN1KMT2ARECQLDNM1CASP2
SCHEMBL25816837 0.85 MEN1 (0.68) MEN1KMT2ARECQLDNM1CASP2
SCHEMBL25817389 0.84 KDM4E (0.48) MEN1KMT2AACHEDRD3
SCHEMBL25817406 0.83 KDM4E (0.47) MEN1KMT2AACHEDRD3
SCHEMBL25817398 0.83 KDM4E (0.52) ACHEDRD3
SCHEMBL19570491 0.82 MEN1 (0.63) MEN1KMT2ARECQLDNM1CASP2
SCHEMBL17145177 0.79 MEN1 (0.61) MEN1KMT2ARECQL

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