SCHEMBL25824041

SCHEMBL25824041

CC[C@H]1O[C@@H](N2C=CCNC2=O)C(OC(=O)c2ccccc2)[C@H]1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 2/20 0.41
USP2 O75604 1/20 0.41
GAPDH P04406 2/20 0.37
LGALS9 O00182 1/20 0.35
LGALS1 P09382 1/20 0.35
LGALS3 P17931 1/20 0.35
LGALS7; LGALS7B P47929 1/20 0.35
RNASE1 P07998 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32

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
SCHEMBL27055215 1.00 MEN1 (0.41) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL23215313 0.84 POLB (0.59) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL23240642 0.84 POLB (0.59) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL25605657 0.79 BCHE (0.37) MEN1KMT2APOLBUSP2GAA
SCHEMBL27055213 0.79 MEN1 (0.40) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL25824040 0.79 MEN1 (0.40) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL26554384 0.78 MEN1 (0.41) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL26554463 0.76 GAPDH (0.41) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL27055211 0.76 CDA (0.44) MEN1KMT2APOLBUSP2GAPDH
SCHEMBL25824039 0.76 CDA (0.44) MEN1KMT2APOLBUSP2GAPDH

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
US-20230220384-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-07-13 US disclosed