SCHEMBL3099629

SCHEMBL3099629

O=C(O)CCCn1c(C(=O)O)cc2cc(OCc3ccc(CCCOCc4ccccc4)cc3)ccc21

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 5/20 0.62
SRD5A2 P31213 1/20 0.57
LTB4R Q15722 1/20 0.56
LTB4R2 Q9NPC1 1/20 0.56
FFAR1 O14842 1/20 0.47

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
SCHEMBL3102127 0.91 SRD5A2 (0.67) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL13802519 0.84 SRD5A2 (0.72) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL2015584 0.80 SRD5A2 (0.63) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL13802531 0.78 SRD5A2 (0.74) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL2207104 0.77 MCL1 (0.74) SRD5A2LTB4RLTB4R2
SCHEMBL700511 0.76 SRD5A2 (0.73) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL4322740 0.74 PLA2G4A (0.57) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL4470968 0.73 SRD5A2 (1.00) PLA2G4ASRD5A2LTB4RLTB4R2
SCHEMBL3094280 0.73 CYSLTR2 (0.51) PLA2G4ASRD5A2
SCHEMBL2016346 0.73 SRD5A2 (0.56) SRD5A2LTB4RLTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318952-B2 Substituted indole derivatives for the treatment of respiratory diseases ONO PHARMACEUTICAL CO., LTD. (JP) 2012-11-27 US claimed
US-8318952-B2 Substituted indole derivatives for the treatment of respiratory diseases ONO PHARMACEUTICAL CO., LTD. (JP) 2012-11-27 US disclosed
EP-2481732-A1 Condensed ring compound and use thereof Ono Pharmaceutical Co., Ltd. (JP) 2012-08-01 EP disclosed
US-20100234368-A1 CONDENSED RING COMPOUND AND USE THEREOF TAKEUCHI JUN 2010-09-16 US disclosed
US-7763610-B2 Carboxylic acid derived benzoxazines as agents for the treatment of respiratory diseases ONO PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US disclosed
US-20060194797-A1 Condensed ring compound and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2006-08-31 US disclosed
EP-1661892-A1 CONDENSED RING COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 EP 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-20100234368-A1 CONDENSED RING COMPOUND AND USE THEREOF CYSLTR2, CYSLTR1, LTB4R2 PLA2G4A 257/4885SRD5A2 1033/4885LTB4R 5/4885
US-20060194797-A1 Condensed ring compound and use thereof CYSLTR2, CYSLTR1, LTB4R2 PLA2G4A 257/4885SRD5A2 1033/4885LTB4R 5/4885

“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.