SCHEMBL29910417

SCHEMBL29910417

CC(c1ccccc1)c1cc(C(=O)O)n[nH]1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 8/20 0.65
HCAR3 P49019 1/20 0.65
KDM5A P29375 1/20 0.51
COMT P21964 3/20 0.48
DAO P14920 2/20 0.47
KDM4A O75164 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
KDM5B Q9UGL1 1/20 0.45
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL8525134 0.83 COMT (0.52) HCAR2HCAR3KDM5ACOMTDAO
SCHEMBL1739326 0.79 HCAR2 (1.00) HCAR2HCAR3KDM5ADAOMAPT
SCHEMBL5599627 0.78 HCAR2 (0.76) HCAR2HCAR3KDM5ADAO
Hydrochloric Acid SCHEMBL31467457 0.78 HCAR2 (0.96) HCAR2HCAR3KDM5ADAOMAPT
SCHEMBL1149787 0.77 HCAR2 (0.59) HCAR2HCAR3KDM5ADAO
SCHEMBL20515900 0.77 HCAR2 (0.51) HCAR2HCAR3KDM5ADAOMAPT
SCHEMBL19763765 0.77 HCAR2 (0.51) HCAR2HCAR3KDM5ADAOMAPT
SCHEMBL19763767 0.77 HCAR2 (0.51) HCAR2HCAR3KDM5ADAOMAPT
SCHEMBL1149300 0.74 HCAR2 (0.57) HCAR2HCAR3DAO
SCHEMBL1149303 0.74 HCAR2 (0.57) HCAR2HCAR3DAO

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-20220289751-A1 COMPOUND HAVING KDM5 INHIBITORY ACTIVITY AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2022-09-15 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-20220289751-A1 COMPOUND HAVING KDM5 INHIBITORY ACTIVITY AND PHARMACEUTICAL USE THEREOF KDM5A, KDM1B, KDM5D HCAR2 2298/4885HCAR3 2618/4885KDM5A 1/4885

“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.