SCHEMBL22883157

SCHEMBL22883157

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

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADK P55263 5/20 0.43
P2RX3 P56373 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP1A2 P05177 1/20 0.38
STAT6 P42226 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
DOT1L Q8TEK3 1/20 0.38

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
SCHEMBL24166706 0.87 ADK (0.54) ADKALDH1A1TP53HTTDOT1L
SCHEMBL18510882 0.87 ADK (0.54) ADKALDH1A1TP53HTTDOT1L
SCHEMBL21137753 0.87 ADK (0.54) ADKALDH1A1TP53HTTDOT1L
SCHEMBL22990432 0.87 ADK (0.54) ADKALDH1A1TP53HTTDOT1L
SCHEMBL23211481 0.87 ADK (0.54) ADKALDH1A1TP53HTTDOT1L
SCHEMBL23989399 0.87 ADK (0.54) ADKALDH1A1TP53HTTDOT1L
SCHEMBL24166703 0.87 ADK (0.45) ADKP2RX3MEN1KMT2AMAPK1
SCHEMBL23989393 0.83 ADK (0.46) ADKMEN1KMT2AALDH1A1HTT
SCHEMBL23989440 0.83 ADK (0.46) ADKMEN1KMT2AALDH1A1HTT
SCHEMBL22883235 0.82 ADK (0.40) ADKMEN1KMT2AMAPK1TDP1

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-20210009630-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2021-01-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210009630-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, IFNAR1 ADK 816/4885P2RX3 46/4885MEN1 307/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.