SCHEMBL2878378

SCHEMBL2878378

CCc1ccc(-c2[nH]c3ccccc3c2CC(=O)OC)cc1S(=O)(=O)NC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.45
TLR7 Q9NYK1 1/20 0.45
EGFR P00533 2/20 0.43
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 1/20 0.41
POLB P06746 1/20 0.41
BRD4 O60885 4/20 0.41
GLA P06280 1/20 0.40
CCR8 P51685 2/20 0.40
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 3/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
BRD3 Q15059 1/20 0.38

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
SCHEMBL5516894 0.91 BRD4 (0.48) TLR8TLR7EGFRPOLBBRD4
SCHEMBL2876476 0.91 ALDH1A1 (0.43) TLR8TLR7ALDH1A1ALOX15BRD4
SCHEMBL2877960 0.90 BRD4 (0.47) TLR8TLR7EGFRALDH1A1ALOX15
SCHEMBL5622868 0.90 BRD4 (0.52) TLR8TLR7EGFRPOLBBRD4
SCHEMBL5520923 0.88 ALDH1A1 (0.44) TLR8TLR7EGFRALDH1A1ALOX15
SCHEMBL27772021 0.88 TLR8 (0.42) TLR8TLR7ALDH1A1ALOX15POLB
SCHEMBL5520104 0.86 GLA (0.53) EGFRALDH1A1GLAKDM4EGAA
SCHEMBL4180150 0.85 TLR8 (0.42) TLR8TLR7ALDH1A1ALOX15POLB
SCHEMBL5510592 0.85 ALDH1A1 (0.48) EGFRALDH1A1BRD4GLAKDM4E
SCHEMBL14393555 0.83 CCR8 (0.36) TLR8TLR7ALDH1A1ALOX15POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066628-B1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI AVENTIS (FR) 2010-10-20 EP disclosed
US-20090176804-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2009-07-09 US disclosed
EP-2066628-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS Sanofi-Aventis (FR) 2009-06-10 EP disclosed
WO-2008014186-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 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-20090176804-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS PTGER2, PTGDR2, CYSLTR2 TLR8 910/4885TLR7 669/4885EGFR 1522/4885

“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.