SCHEMBL25142173

SCHEMBL25142173

Cc1cc(O)cc2oc(=O)c(C(=O)O)cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.61
MAOA P21397 3/20 0.54
CA12 O43570 3/20 0.49
CA9 Q16790 3/20 0.49
CA1 P00915 2/20 0.49
CA4 P22748 2/20 0.49
CA6 P23280 2/20 0.49
CA5A P35218 2/20 0.49
CA7 P43166 2/20 0.49
CA14 Q9ULX7 2/20 0.49
CA5B Q9Y2D0 2/20 0.49
CA2 P00918 1/20 0.49
GPR35 Q9HC97 6/20 0.48
KDM4E B2RXH2 4/20 0.48
HTT P42858 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
CLK2 P49760 1/20 0.48
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
GLA P06280 2/20 0.47

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
SCHEMBL11510774 0.85 CA12 (0.54) MAOBMAOACA12CA9CA1
SCHEMBL30022330 0.82 MAOB (0.67) MAOBMAOACA12CA9KDM4E
SCHEMBL24023163 0.81 MAOA (0.48) MAOBMAOACA12CA9CA1
SCHEMBL6109694 0.81 MIF (0.64) MAOBMAOACA12CA9CA4
SCHEMBL31113776 0.81 GPR35 (0.50) MAOBMAOACA12CA9CA1
SCHEMBL23957727 0.80 MAOA (0.47) MAOBMAOACA12CA9CA1
SCHEMBL14326441 0.80 CA12 (0.54) MAOBMAOACA12CA9CA1
SCHEMBL1406253 0.80 SLC16A3 (0.59) MAOBCA12CA9CA1CA4
SCHEMBL8357020 0.79 KDM4E (0.55) MAOBMAOACA12CA9CA1
SCHEMBL18025632 0.77 KDM4E (0.57) MAOBMAOACA12CA9CA1

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-20230119408-A1 NUCLEOTIDE ANALOGS AND USES THEREOF FIRST-CITIZENS BANK & TRUST COMPANY 2023-04-20 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-20230119408-A1 NUCLEOTIDE ANALOGS AND USES THEREOF NUDT1, PNP, NT5C2 MAOB 1986/4885MAOA 2356/4885CA12 4830/4885

“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.