SCHEMBL15052087

SCHEMBL15052087

CCOC(=O)COc1ccn(Cc2cc(Br)ccc2OCC(CC)CC)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 14/20 0.44
PTGDR2 Q9Y5Y4 2/20 0.38
POLB P06746 1/20 0.38
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 2/20 0.37
CCR5 P51681 1/20 0.36
CYP2C19 P33261 1/20 0.35

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
SCHEMBL15052046 0.85 PTGER1 (0.47) PTGER1CYP1A2
SCHEMBL15052594 0.80 PTGER1 (0.47) PTGER1PTGDR2CYP1A2
SCHEMBL14955666 0.77 PTGER1 (0.48) PTGER1PTGDR2CYP1A2
SCHEMBL15052310 0.75 PTGER1 (0.51) PTGER1PTGDR2CYP1A2
SCHEMBL15052208 0.75 PTGER1 (0.52) PTGER1CYP1A2
SCHEMBL15051959 0.74 PTGER1 (0.39) PTGER1PTGDR2CYP1A2CCR5
SCHEMBL15070182 0.74 PTGER1 (0.56) PTGER1CYP1A2
SCHEMBL19610429 0.74 PTGER1 (0.48) PTGER1PTGDR2CYP1A2
SCHEMBL15052438 0.73 PTGER1 (0.46) PTGER1ALDH1A1CYP1A2
SCHEMBL13903612 0.72 PTGDR2 (0.67) PTGDR2POLBPABPC1APOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794574-B1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN INC (US) 2017-11-08 EP disclosed
US-8969589-B2 Compounds acting at multiple prostaglandin receptors giving a general anti-inflammatory response ALLERGAN, INC. (US) 2015-03-03 US disclosed
EP-2794574-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2014-10-29 EP disclosed
WO-2013096501-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-06-27 WO disclosed
US-20130165665-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-06-27 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-20130165665-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE PTGER1, PTGER4, PTGER2 PTGER1 1/4885PTGDR2 9/4885POLB 4307/4885

“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.