SCHEMBL1467758

SCHEMBL1467758

COC(=O)Cn1c(C)c(Cc2ccccc2S(=O)(=O)Nc2ccccc2C)c2cc(F)ccc21

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.59
PTGIR P43119 1/20 0.43
PTGDR Q13258 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HK1 P19367 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 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
SCHEMBL1465506 0.91 PTGDR2 (0.71) PTGDR2PTGIRPTGDR
SCHEMBL1467815 0.90 PTGDR2 (0.63) PTGDR2PTGIRPTGDRALDH1A1LMNA
SCHEMBL1465346 0.88 PTGDR2 (0.62) PTGDR2PTGIRPTGDRALDH1A1LMNA
SCHEMBL1466770 0.87 PTGDR2 (0.67) PTGDR2PTGIRPTGDRALDH1A1LMNA
SCHEMBL3718015 0.86 PTGDR2 (0.56) PTGDR2PTGIRPTGDRALDH1A1LMNA
SCHEMBL1466461 0.86 PTGDR2 (0.65) PTGDR2PTGIRPTGDRALDH1A1LMNA
SCHEMBL1465500 0.84 PTGDR2 (0.59) PTGDR2PTGIRPTGDR
SCHEMBL1465975 0.84 PTGDR2 (0.82) PTGDR2
SCHEMBL1466236 0.84 PTGDR2 (0.76) PTGDR2
SCHEMBL3717549 0.83 PTGDR2 (0.53) PTGDR2PTGIRPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130225617-A1 INDOLES AND THEIR THERAPEUTIC USE PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2013-08-29 US disclosed
US-8394836-B2 Indoles and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2013-03-12 US disclosed
EP-2327693-A1 Indoles and their therapeutic use Pulmagen Therapeutics (Asthma) Limited (GB) 2011-06-01 EP disclosed
US-20110071175-A1 Indoles and Their Therapeutic Use GB005, INC. 2011-03-24 US disclosed
EP-2229358-A1 INDOLES AND THEIR THERAPEUTIC USE Pulmagen Therapeutics (Asthma) Limited (GB) 2010-09-22 EP disclosed
WO-2009077728-A1 INDOLES AND THEIR THERAPEUTIC USE ARGENTA DISCOVERY LIMITED (GB) 2009-06-25 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 (2 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-20130225617-A1 INDOLES AND THEIR THERAPEUTIC USE IDO2, IDO1, RORB PTGDR2 39/4885PTGIR 183/4885PTGDR 60/4885
US-20110071175-A1 Indoles and Their Therapeutic Use FPR3, HRH2, HRH4 PTGDR2 161/4885PTGIR 417/4885PTGDR 139/4885

“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.