SCHEMBL25004848

SCHEMBL25004848

Cc1nc(C(=O)O)cn1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.41
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
KDM4E B2RXH2 4/20 0.37
ALOX15 P16050 3/20 0.37
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ACMSD Q8TDX5 1/20 0.37
HIF1A Q16665 1/20 0.35
DAO P14920 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BRD4 O60885 1/20 0.34
ALDH1A1 P00352 3/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 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
SCHEMBL26963218 0.77 PTGS1 (0.39) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL7489316 0.77 RXFP1 (0.42) RXFP1PTGS1PTGS2KDM4EALOX15
Hydrochloric Acid SCHEMBL31555571 0.75 RXFP1 (0.41) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL13733079 0.72 RXFP1 (0.39) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL21314950 0.69 NOTUM (0.50) PTGS1PTGS2KDM4EALOX15TSHR
SCHEMBL14239269 0.69 CHRM4 (0.36) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL13732305 0.67 PKM (0.36) RXFP1PTGS1PTGS2KDM4EL3MBTL1
SCHEMBL13736015 0.67 PKM (0.36) RXFP1PTGS1PTGS2KDM4EL3MBTL1
SCHEMBL13735175 0.67 RXFP1 (0.36) RXFP1PTGS1PTGS2KDM4EL3MBTL1
SCHEMBL4734703 0.67 BRD4 (0.38) RXFP1PTGS1PTGS2KDM4ETSHR

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-20230039553-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2023-02-09 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-20230039553-A1 CD73 COMPOUNDS ENTPD5, ENTPD1, NT5E RXFP1 2649/4885PTGS1 1287/4885PTGS2 1398/4885

“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.