SCHEMBL9915041

SCHEMBL9915041

C/C=C/[C@@H](O)CCCCC

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.61
DDAH1 O94760 1/20 0.61
GAPDH P04406 1/20 0.61
MAPT P10636 1/20 0.61
ACHE P22303 1/20 0.46
BACE1 P56817 1/20 0.46
PPARG P37231 2/20 0.45
FPR2 P25090 2/20 0.45
GPR132 Q9UNW8 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.42

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
SCHEMBL7451658 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL7451666 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL11439697 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL2416574 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL31303623 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL12300774 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL10675600 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL8907239 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL11439694 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE
SCHEMBL2416572 0.98 TRPA1 (0.59) TRPA1DDAH1GAPDHMAPTACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201620-A Inhaled iloprost for on-demand treatment of pulmonary arterial hypertension 尤斯图斯-李比希大学 2024-06-14 CN disclosed
US-20140377337-A1 TRANSDERMAL APPLICATION OF PROSTAGLANDIN E1 FOR THE TREATMENT OF OCULAR ISCHEMIA STEIGERWALT JR ROBERT DAVIS (US) 2014-12-25 US disclosed
WO-2013114418-A1 TRANSDERMAL ADMINISTRATION OF PROSTAGLANDIN E1 FOR THE TREATMENT OF OCULAR ISCHEMIA STEIGERWALT ROBERT DAVIS JR (IT) 2013-08-08 WO disclosed
EP-1481976-B1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2012-11-07 EP disclosed
US-8198315-B2 Therapeutic substituted cyclic lactams ALLERGAN, INC. (US) 2012-06-12 US disclosed
US-8026273-B2 8-azaprostaglandin derivative compound and agent comprising the compound as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2011-09-27 US disclosed
US-8026273-B2 8-azaprostaglandin derivative compound and agent comprising the compound as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2011-09-27 US disclosed
US-20100113388-A1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUND AND AGENT COMPRISING THE COMPOUND AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2010-05-06 US disclosed
US-20100113388-A1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUND AND AGENT COMPRISING THE COMPOUND AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2010-05-06 US disclosed
US-7683094-B2 8-azaprostaglandin derivative compound and agent comprising the compound as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-03-23 US disclosed
US-7683094-B2 8-azaprostaglandin derivative compound and agent comprising the compound as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-03-23 US disclosed
US-20090042885-A1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUND AND AGENT COMPRISING THE COMPOUND AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2009-02-12 US disclosed
US-20090042885-A1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUND AND AGENT COMPRISING THE COMPOUND AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2009-02-12 US disclosed
US-7402605-B2 8-azaprostaglandin derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-07-22 US disclosed
US-7402605-B2 8-azaprostaglandin derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-07-22 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 (3 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-20090042885-A1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUND AND AGENT COMPRISING THE COMPOUND AS ACTIVE INGREDIENT PTGER2, PTGIS, HPGDS TRPA1 1811/4885DDAH1 3384/4885GAPDH 1142/4885
US-20140377337-A1 TRANSDERMAL APPLICATION OF PROSTAGLANDIN E1 FOR THE TREATMENT OF OCULAR ISCHEMIA PTGER1, PTGS1, PTGES TRPA1 333/4885DDAH1 3404/4885GAPDH 1185/4885
US-20100113388-A1 8-AZAPROSTAGLANDIN DERIVATIVE COMPOUND AND AGENT COMPRISING THE COMPOUND AS ACTIVE INGREDIENT PTGER2, PTGIS, HPGDS TRPA1 1811/4885DDAH1 3384/4885GAPDH 1142/4885

“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.