SCHEMBL24166703

SCHEMBL24166703

C[C@@H]1C(CO)O[C@@H](n2cc(F)c3c(=O)[nH]cnc32)[C@@H]1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADK P55263 3/20 0.45
PAX8 Q06710 1/20 0.41
P2RX3 P56373 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GMNN O75496 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
DNMT1 P26358 1/20 0.40
THPO P40225 1/20 0.40
MTOR P42345 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
BLM P54132 1/20 0.40
HBB P68871 1/20 0.40
PMP22 Q01453 1/20 0.40
HPGD P15428 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL25679894 0.92 ADK (0.43) ADKP2RX3LMNAHBBPMP22
SCHEMBL22883235 0.91 ADK (0.40) ADKMEN1KMT2AALDH1A1LMNA
SCHEMBL24166706 0.90 ADK (0.54) ADKPAX8GMNNALDH1A1LMNA
SCHEMBL23989399 0.90 ADK (0.54) ADKPAX8GMNNALDH1A1LMNA
SCHEMBL21137753 0.90 ADK (0.54) ADKPAX8GMNNALDH1A1LMNA
SCHEMBL22990432 0.90 ADK (0.54) ADKPAX8GMNNALDH1A1LMNA
SCHEMBL23211481 0.90 ADK (0.54) ADKPAX8GMNNALDH1A1LMNA
SCHEMBL18510882 0.90 ADK (0.54) ADKPAX8GMNNALDH1A1LMNA
SCHEMBL22883157 0.87 ADK (0.43) ADKP2RX3MEN1KMT2AALDH1A1
SCHEMBL23989393 0.86 ADK (0.46) ADKPAX8MEN1KMT2AALDH1A1

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-3707151-B1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICALS CO (JP) 2022-01-05 EP disclosed