SCHEMBL26375007

SCHEMBL26375007

COc1ccc(COC(=O)C2CCC[C@H]2C(=O)On2nnc3cccnc32)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.38
POLB P06746 2/20 0.38
THRB P10828 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPK1 P28482 3/20 0.38
PDE4B Q07343 4/20 0.38
PDE4D Q08499 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.37
F2 P00734 1/20 0.36
RECQL P46063 2/20 0.36
RAB9A P51151 1/20 0.36
HTR6 P50406 1/20 0.36
ATP4A P20648 1/20 0.36

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
SCHEMBL23959350 0.84 TSHR (0.36) MEN1KMT2ATSHRALDH1A1TP53
SCHEMBL23961062 0.84 TSHR (0.36) MEN1KMT2ATSHRALDH1A1TP53
SCHEMBL23961111 0.83 TSHR (0.37) MEN1KMT2ATSHRALDH1A1TP53
SCHEMBL23959352 0.83 TSHR (0.37) MEN1KMT2ATSHRALDH1A1TP53
SCHEMBL26374992 0.76 KMT2A (0.38) MEN1KMT2ATSHRALDH1A1POLB
SCHEMBL12533279 0.76 KMT2A (0.51) MEN1KMT2ATSHRALDH1A1POLB
SCHEMBL1766747 0.76 KMT2A (0.51) MEN1KMT2ATSHRALDH1A1POLB
SCHEMBL1766751 0.76 KMT2A (0.51) MEN1KMT2ATSHRALDH1A1POLB
SCHEMBL23961047 0.76 KMT2A (0.51) MEN1KMT2ATSHRALDH1A1POLB
SCHEMBL23959329 0.74 KMT2A (0.54) MEN1KMT2ATSHRALDH1A1POLB

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
EP-4252755-A2 THERAPEUTIC COMPOUNDS C4x Discovery Limited (GB) 2023-10-04 EP disclosed