SCHEMBL30467553

SCHEMBL30467553

CC(C)Oc1ccc2c(=O)c(C(=O)O)c[nH]c2c1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDH2 P40926 2/20 0.62
ALDH1A1 P00352 2/20 0.62
HPGD P15428 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
MEN1 O00255 1/20 0.56
CYP1A2 P05177 1/20 0.56
ALOX12 P18054 1/20 0.56
KMT2A Q03164 1/20 0.56
HTT P42858 1/20 0.53

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
SCHEMBL3709669 0.86 ALDH1A1 (0.64) MDH2ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL591695 0.82 ALDH1A1 (0.58) ALDH1A1MEN1CYP1A2KMT2AHTT
SCHEMBL11246680 0.80 MDH2 (0.68) MDH2ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL2976313 0.80 ALDH1A1 (0.65) MDH2ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL2974546 0.78 ALDH1A1 (0.62) MDH2ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL591684 0.77 ALDH1A1 (0.50) MDH2ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL18589525 0.76 CYP1A2 (0.64) MDH2ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL30075344 0.76 MAPT (0.73) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL590922 0.76 MAPT (0.73) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL2050601 0.75 CYP1A2 (0.59) MDH2ALDH1A1HPGDSMN1; SMN2MEN1

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-20230190730-A1 4-OXOQUINOLINE COMPOUND AND USE THEREOF AS PHARMACEUTICAL AGENT JAPAN TOBACCO INC. (JP) 2023-06-22 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-20230190730-A1 4-OXOQUINOLINE COMPOUND AND USE THEREOF AS PHARMACEUTICAL AGENT IMPDH1, IMPDH2, DNTT MDH2 2543/4885ALDH1A1 717/4885HPGD 1284/4885

“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.