SCHEMBL15499982

SCHEMBL15499982

O=C(O)Cc1ccc(CC(=O)O)c(O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.73
TSHR P16473 4/20 0.73
KDM4E B2RXH2 4/20 0.73
HPGD P15428 4/20 0.73
HSD17B10 Q99714 4/20 0.73
MAPT P10636 3/20 0.73
NFKB1 P19838 2/20 0.73
TDP1 Q9NUW8 2/20 0.73
LMNA P02545 2/20 0.73
RGS12 O14924 1/20 0.73
POLB P06746 1/20 0.73
APEX1 P27695 1/20 0.73
THPO P40225 1/20 0.73
BLM P54132 1/20 0.73
GNAI1 P63096 1/20 0.73
PMP22 Q01453 1/20 0.73
HIF1A Q16665 1/20 0.73
CA2 P00918 2/20 0.60
CAMK2A Q9UQM7 2/20 0.56
ALDH1A1 P00352 4/20 0.55

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
SCHEMBL15499985 0.88 KDM4E (0.58) GAATSHRKDM4EHPGDHSD17B10
SCHEMBL14093025 0.86 TRPA1 (0.55) GAATSHRKDM4EHPGDHSD17B10
SCHEMBL28092168 0.86 GAA (0.55) GAATSHRKDM4EHPGDHSD17B10
SCHEMBL10825727 0.85 GAA (0.70) GAATSHRKDM4EHPGDHSD17B10
3,4-Dihydroxyphenylacetic Acid SCHEMBL29382155 0.84 GAA (1.00) GAATSHRKDM4EHPGDHSD17B10
SCHEMBL1173033 0.84 GAA (0.57) GAATSHRKDM4EHPGDHSD17B10
3,4-Dihydroxyphenylacetic Acid SCHEMBL36348 0.84 GAA (1.00) GAATSHRKDM4EHPGDHSD17B10
SCHEMBL2066538 0.83 GAA (0.68) GAATSHRKDM4EHPGDHSD17B10
SCHEMBL30696810 0.83 GAA (0.68) GAATSHRKDM4EHPGDHSD17B10
3,4-Dihydroxyphenylacetic Acid SCHEMBL8214151 0.83 GAA (0.96) GAATSHRKDM4EHPGDHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8691002-B2 Organic black pigments and their preparation BASF SE (DE) 2014-04-08 US disclosed
US-8669026-B2 Black matrix for colour filters BASF SE (DE) 2014-03-11 US disclosed
US-20110294385-A1 ORGANIC BLACK PIGMENTS AND THEIR PREPARATION BASF SE (DE) 2011-12-01 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-20110294385-A1 ORGANIC BLACK PIGMENTS AND THEIR PREPARATION IK, CRY1, PAH GAA 3042/4885TSHR 4003/4885KDM4E 225/4885

“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.