SCHEMBL4119396

SCHEMBL4119396

COC(Oc1ccc(-c2ccccc2)cc1)c1cc(C(=O)O)oc1C

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 17/20 0.54
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
CYP1A2 P05177 1/20 0.43
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
CYP2C19 P33261 1/20 0.43
PPARG P37231 1/20 0.41
PPARA Q07869 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
SCHEMBL6189735 0.74 PTGER4 (0.52) PTGER4ALDH1A1HPGD
SCHEMBL1756460 0.70 PTGER4 (1.00) PTGER4
SCHEMBL3537543 0.68 PTGER4 (1.00) PTGER4
SCHEMBL3535869 0.68 PTGER4 (0.42) PTGER4ALDH1A1HPGDCYP1A2GAA
SCHEMBL14072914 0.66 APEX1 (0.49) PTGER4ALDH1A1HPGD
SCHEMBL5712864 0.66 KMT2A (0.44) ALDH1A1HPGDGAAPKM
SCHEMBL2036102 0.66 LMNA (0.42) ALDH1A1CYP1A2GAACYP2C9PKM
SCHEMBL3533268 0.66 PTGER4 (1.00) PTGER4
SCHEMBL27519880 0.65 ACMSD (0.53)
SCHEMBL29742912 0.64 PTGER4 (0.61) PTGER4ALDH1A1HPGD

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-20090143437-A1 EP4 RECEPTOR ANTAGONISTS ASTERAND UK LIMITED (GB) 2009-06-04 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-20090143437-A1 EP4 RECEPTOR ANTAGONISTS PTGER4, NR4A1, NR4A2 PTGER4 1/4885ALDH1A1 1522/4885HPGD 618/4885

“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.