SCHEMBL25824040

SCHEMBL25824040

CC[C@H]1O[C@@H](N2CC=CNC2=O)C(OC(=O)c2ccccc2)[C@H]1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
USP2 O75604 1/20 0.40
POLB P06746 1/20 0.40
LGALS9 O00182 1/20 0.36
LGALS1 P09382 1/20 0.36
LGALS3 P17931 1/20 0.36
LGALS7; LGALS7B P47929 1/20 0.36
GAPDH P04406 2/20 0.35
RNASE1 P07998 1/20 0.35
PTPN1 P18031 2/20 0.34
GAA P10253 1/20 0.33
CHRNA7 P36544 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33

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
SCHEMBL27055213 1.00 MEN1 (0.40) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL23240640 0.82 POLB (0.59) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL23215197 0.82 POLB (0.59) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL27055215 0.79 MEN1 (0.41) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL25824041 0.79 MEN1 (0.41) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL26554384 0.78 MEN1 (0.41) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL26554463 0.77 GAPDH (0.41) MEN1KMT2AUSP2POLBLGALS9
SCHEMBL16904879 0.76 MEN1 (0.51) MEN1KMT2AUSP2POLBGAPDH
SCHEMBL25504886 0.76 MEN1 (0.51) MEN1KMT2AUSP2POLBGAPDH
SCHEMBL25504874 0.76 MEN1 (0.51) MEN1KMT2AUSP2POLBGAPDH

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