SCHEMBL4523085

SCHEMBL4523085

O=C(O)c1ccc(OCCCc2ccc(OCc3ccc(-c4ccccc4)cc3)cc2)c(C(=O)N[C@@H]2CCCC[C@@H]2C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.64
RAB9A P51151 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
FFAR1 O14842 1/20 0.41
AXL P30530 2/20 0.40
MERTK Q12866 2/20 0.40
NR1H4 Q96RI1 3/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
SGMS2 Q8NHU3 1/20 0.39
CGAS Q8N884 1/20 0.39

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
SCHEMBL4523082 1.00 CYSLTR2 (0.64) CYSLTR2RAB9APDE4APDE4BPDE4C
SCHEMBL4518376 0.92 CYSLTR2 (0.75) CYSLTR2FFAR1NR1H4
SCHEMBL4518377 0.92 CYSLTR2 (0.75) CYSLTR2FFAR1NR1H4
SCHEMBL4518895 0.87 CYSLTR2 (0.76) CYSLTR2RAB9APDE4APDE4BPDE4C
SCHEMBL4522451 0.87 CYSLTR2 (0.76) CYSLTR2RAB9APDE4APDE4BPDE4C
SCHEMBL4528314 0.86 CYSLTR2 (0.48) CYSLTR2AXLMERTKKMT2A
SCHEMBL4528312 0.86 CYSLTR2 (0.48) CYSLTR2AXLMERTKKMT2A
SCHEMBL4530713 0.86 CYSLTR2 (0.70) CYSLTR2RAB9APDE4APDE4BPDE4C
SCHEMBL4530711 0.86 CYSLTR2 (0.70) CYSLTR2RAB9APDE4APDE4BPDE4C
SCHEMBL13918311 0.83 CYSLTR2 (0.89) CYSLTR2NR1H4MEN1ALDH1A1KMT2A

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
US-7498460-B2 Isophthalic acid derivatives BAYER HEALTHCARE AG (DE) 2009-03-03 US disclosed
US-7498460-B2 Isophthalic acid derivatives BAYER HEALTHCARE AG (DE) 2009-03-03 US disclosed
US-7498460-B2 Isophthalic acid derivatives BAYER HEALTHCARE AG (DE) 2009-03-03 US disclosed
US-20060154912-A1 Isophtalic acid derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-07-13 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-20060154912-A1 Isophtalic acid derivatives VHL, FABP3, CPT1A CYSLTR2 1426/4885RAB9A 3779/4885PDE4A 1912/4885

“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.