SCHEMBL1660735

SCHEMBL1660735

COc1ccc(/C=C/C(=O)OCC(O)COC(=O)C=Cc2ccc(O)cc2)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 6/20 0.57
CA12 O43570 2/20 0.57
CA7 P43166 2/20 0.57
CA9 Q16790 2/20 0.57
CA14 Q9ULX7 2/20 0.57
CA4 P22748 1/20 0.57
CA6 P23280 1/20 0.57
HTR7 P34969 1/20 0.57
CA5A P35218 1/20 0.57
CA5B Q9Y2D0 1/20 0.57
FDPS P14324 2/20 0.56
TTR P02766 1/20 0.56
NFE2L2 Q16236 1/20 0.56
MAOB P27338 2/20 0.55
ABCB1 P08183 1/20 0.55
AKR1B1 P15121 1/20 0.55
MAOA P21397 1/20 0.55
ALDH1A1 P00352 2/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53

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
SCHEMBL1660732 1.00 MET (0.57) METCA12CA7CA9CA14
SCHEMBL1660737 1.00 MET (0.57) METCA12CA7CA9CA14
SCHEMBL12731827 0.90 TTR (0.65) CA12CA7CA9CA14CA4
SCHEMBL1660429 0.90 TNFRSF1A (0.60) FDPSTTRNFE2L2MAOBALDH1A1
SCHEMBL12794384 0.90 TTR (0.60) METCA12CA7CA9CA14
SCHEMBL11903912 0.90 TTR (0.65) CA12CA7CA9CA14CA4
SCHEMBL15169491 0.90 FDPS (0.59) FDPSTTRNFE2L2MAOBALDH1A1
SCHEMBL1660425 0.90 TNFRSF1A (0.60) FDPSTTRNFE2L2MAOBALDH1A1
SCHEMBL11903909 0.90 TTR (0.65) CA12CA7CA9CA14CA4
SCHEMBL1660427 0.90 TNFRSF1A (0.60) FDPSTTRNFE2L2MAOBALDH1A1

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-2486026-B1 DERIVATIVES OF DI(PHENYLPROPANOID) GLYCEROL FOR THE TREATMENT OF CANCER MACGREGOR ALEXANDER (CA) 2020-06-24 EP disclosed
US-10052301-B2 Derivatives of propane diyl dicinnamate ORX PHARMACEUTICAL CORPORATION (CA) 2018-08-21 US disclosed
US-20150246014-A1 Derivatives of Propane Diyl Dicinnamate ORX PHARMACEUTICAL CORPORATION (CA) 2015-09-03 US disclosed
US-9061993-B2 Derivatives of propane diyl dicinnamate Toronto Institute of Pharmaceutical Technology (CA) 2015-06-23 US disclosed
US-20110086912-A1 Derivatives of Propane Diyl Dicinnamate MACGREGOR ALEXANDER 2011-04-14 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-20150246014-A1 Derivatives of Propane Diyl Dicinnamate H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DECR2, DECR1 MET 142/4885CA12 1177/4885CA7 423/4885
US-10052301-B2 Derivatives of propane diyl dicinnamate H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DECR2, DECR1 MET 142/4885CA12 1177/4885CA7 423/4885
US-20110086912-A1 Derivatives of Propane Diyl Dicinnamate H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DECR2, DECR1 MET 127/4885CA12 1184/4885CA7 445/4885

“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.