SCHEMBL17486152

SCHEMBL17486152

CC1(C)OB(c2ccc(-c3ccc4c(c3)C(F)(F)OC4(F)F)nc2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.50
LIPG Q9Y5X9 10/20 0.42
LPL P06858 9/20 0.42
PDGFRB P09619 2/20 0.34
KDR P35968 2/20 0.34
SNCA P37840 1/20 0.33
F11 P03951 2/20 0.32
F2 P00734 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
FFAR1 O14842 1/20 0.31

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
SCHEMBL17486181 0.85 DGAT1 (0.50) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL17486107 0.84 DGAT1 (0.52) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL21125909 0.82 DGAT1 (0.67) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL29688284 0.82 DGAT1 (0.52) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL17477815 0.82 DGAT1 (0.52) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL19295085 0.81 DGAT1 (0.49) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL17486009 0.81 DGAT1 (0.54) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL20007153 0.81 DGAT1 (0.51) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL18015417 0.81 DGAT1 (0.57) DGAT1LIPGLPLSNCA
SCHEMBL15614863 0.80 LPL (0.46) LIPGLPLF11F2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3174890-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-03-13 EP disclosed
US-9853228-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-26 US disclosed
US-9853228-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-26 US disclosed
US-20170250353-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2017-08-31 US disclosed
US-20170250353-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2017-08-31 US disclosed
WO-2016015815-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2016-02-04 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-20170250353-A1 METAL COMPLEXES SOD1, AP1M1, AP3M1 DGAT1 2063/4885LIPG 3210/4885LPL 3163/4885

“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.