SCHEMBL23484192

SCHEMBL23484192

CCOC(=O)c1ccc(O)c(-c2cccnc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 3/20 0.52
HSD17B2 P37059 1/20 0.51
MAPT P10636 4/20 0.51
ACHE P22303 1/20 0.50
MMP2 P08253 1/20 0.50
MMP13 P45452 1/20 0.50
MMP14 P50281 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL29363035 0.83 KDM4E (0.56) ALDH1A1KDM4EMAPTACHEMMP2
SCHEMBL5735824 0.82 MKNK1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL5487018 0.81 CYP11B2 (0.74) ALDH1A1KDM4EMAPTACHEMMP2
SCHEMBL1895643 0.80 CYP2C9 (0.57) ALDH1A1KDM4EMAPTMMP2MMP13
SCHEMBL18355728 0.78 CYP3A4 (0.55) ALDH1A1KDM4EMAPTMMP2MMP13
SCHEMBL10028690 0.78 ALDH1A1 (0.56) ALDH1A1KDM4EMAPTMMP2MMP13
SCHEMBL7809778 0.78 IMPDH2 (0.64) ALDH1A1KDM4EMAPTACHEMMP2
Ethyl Nicotinate SCHEMBL24853 0.77 L3MBTL1 (0.71) ALDH1A1KDM4EMAPTKMT2AMEN1
Ethyl Nicotinate SCHEMBL8164637 0.77 L3MBTL1 (0.71) ALDH1A1KDM4EMAPTKMT2AMEN1
Ethyl Nicotinate SCHEMBL1330922 0.77 L3MBTL1 (0.71) ALDH1A1KDM4EMAPTKMT2AMEN1

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-20210171883-A1 ANTIVIRAL WIPER FUJIFILM CORPORATION (JP) 2021-06-10 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-20210171883-A1 ANTIVIRAL WIPER CGAS, PRKX, PDE4C CA12 2396/4885CA1 2414/4885CA2 1789/4885

“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.