SCHEMBL13468282

SCHEMBL13468282

CC/C=C\CCCC(=O)Oc1cc(O)cc(O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.53
▸ NR1I2 O75469 2/20 0.53
▸ PTGS2 P35354 2/20 0.53
▸ PGR P06401 1/20 0.53
▸ PDE4D Q08499 1/20 0.53
▸ ALDH1A1 P00352 5/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ F7 P08709 3/20 0.46
▸ CYP19A1 P11511 3/20 0.46
▸ F3 P13726 3/20 0.46
▸ PTGS1 P23219 2/20 0.46
▸ PPARG P37231 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ PPARD Q03181 2/20 0.46
▸ PPARA Q07869 2/20 0.46
▸ OXER1 Q8TDS5 2/20 0.46

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
SCHEMBL18471978 0.97 ADORA3 (0.57) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18471979 0.88 ALDH1A1 (0.49) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18471980 0.86 ADORA3 (0.49) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL17212394 0.85 ALDH1A1 (0.49) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL17212642 0.81 ALDH1A1 (0.51) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL29466470 0.81 ALDH1A1 (0.51) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL17962461 0.81 KMT2A (0.45) ALDH1A1HSD17B10KMT2AMAPTMEN1
SCHEMBL9752590 0.80 KMT2A (0.45) PTGS2CYP3A4ALOX15KMT2AMAPT
SCHEMBL18487106 0.80 ALDH1A1 (0.44) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18471974 0.80 ALDH1A1 (0.44) ADORA3NR1I2PTGS2PGRPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140120058-A1 POLYMER CONJUGATED PROSTAGLANDIN ANALOGUES POLYACTIVA PTY LTD 2014-05-01 — — US disclosed
US-20140120058-A1 POLYMER CONJUGATED PROSTAGLANDIN ANALOGUES POLYACTIVA PTY LTD 2014-05-01 — — US disclosed
WO-2012139164-A1 POLYMER CONJUGATED PROSTAGLANDIN ANALOGUES POLYACTIVA PTY LTD (AU) 2012-10-18 — — 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 (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-20140120058-A1 POLYMER CONJUGATED PROSTAGLANDIN ANALOGUES PTGIS, PTGS2, PTGES ADORA3 2094/4885NR1I2 1038/4885PTGS2 2/4885

“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.

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