SCHEMBL19851474

SCHEMBL19851474

COC(=O)C(C(=O)/C=C/c1ccc(O)cc1)C(=O)/C=C/c1ccc(O)c(Oc2ccccc2/C=C/C(=O)C(C(=O)/C=C/c2ccccc2O)C(=O)OC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.61
MMP9 P14780 2/20 0.61
MMP13 P45452 2/20 0.61
MMP8 P22894 1/20 0.61
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
ABCB1 P08183 1/20 0.48
AKR1B1 P15121 1/20 0.48
APP P05067 7/20 0.47
MAPT P10636 7/20 0.47
BACE1 P56817 5/20 0.47
LY96 Q9Y6Y9 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM1A O60341 1/20 0.43

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
SCHEMBL2124592 0.79 MMP2 (0.59) MMP2MMP9MMP13MMP8MAOA
SCHEMBL2122001 0.77 MMP2 (1.00) MMP2MMP9MMP13MMP8MAOA
SCHEMBL30540958 0.77 MMP2 (1.00) MMP2MMP9MMP13MMP8MAOA
SCHEMBL2124084 0.77 MMP2 (1.00) MMP2MMP9MMP13MMP8MAOA
SCHEMBL19958251 0.72 MMP2 (0.88) MMP2MMP9MMP13MMP8MAOA
SCHEMBL2817800 0.72 APP (0.80) MMP2MMP9MMP13MMP8MAOA
SCHEMBL3218050 0.72 APP (0.80) MMP2MMP9MMP13MMP8MAOA
SCHEMBL2123091 0.71 MMP2 (0.70) MMP2MMP9MMP13MMP8MAOA
SCHEMBL10084348 0.70 MMP2 (0.73) MMP2MMP9MMP13MMP8MAOA
SCHEMBL16558601 0.70 MMP2 (0.82) MMP2MMP9MMP13MMP8MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180036262-A1 CHEMICALLY MODIFIED CURCUMINS FOR USE IN THE PRODUCTION OF LIPOXINS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2018-02-08 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-20180036262-A1 CHEMICALLY MODIFIED CURCUMINS FOR USE IN THE PRODUCTION OF LIPOXINS ALOX15B, ALOX15, ALOX12 MMP2 691/4885MMP9 1330/4885MMP13 483/4885

“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.