SCHEMBL4415520

SCHEMBL4415520

O=C(O)c1c(C(=O)O)c(O)c2ccccc2c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.54
HPGD P15428 3/20 0.54
KDM4E B2RXH2 3/20 0.54
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
CYP1A2 P05177 1/20 0.54
GLA P06280 1/20 0.54
CYP2C19 P33261 1/20 0.54
CYP2C9 P11712 2/20 0.54
TSHR P16473 2/20 0.54
THRB P10828 1/20 0.54
ALOX12 P18054 1/20 0.54
ATIC P31939 1/20 0.54
DHODH Q02127 3/20 0.50
PDE10A Q9Y233 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50

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
SCHEMBL31414101 1.00 HSD17B10 (0.54) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL27572021 0.93 HSD17B10 (0.48) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL28261469 0.90 DHODH (0.52) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL344711 0.90 HSD17B10 (0.50) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL901598 0.88 HSD17B10 (0.48) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL2477681 0.87 HSD17B10 (0.58) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL7537511 0.85 DHODH (0.52) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL29291851 0.84 HMGB1 (0.46) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL5162563 0.84 PDE10A (0.50) HSD17B10HPGDKDM4EALDH1A1MEN1
SCHEMBL29260803 0.84 DHODH (0.55) HSD17B10HPGDKDM4EALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090318523-A1 BENZOISOINDOLE DERIVATIVES AND THEIR USE AS EP4 RECEPTOR AGONISTS GLAXO GROUP LIMITED 2009-12-24 US disclosed
WO-2008012347-A1 BENZO [F] ISOINDOLES AS EP4 RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2008-01-31 WO 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-20090318523-A1 BENZOISOINDOLE DERIVATIVES AND THEIR USE AS EP4 RECEPTOR AGONISTS PTGER4, PTGER3, HTR4 HSD17B10 2593/4885HPGD 732/4885KDM4E 1532/4885

“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.