SCHEMBL19794483

SCHEMBL19794483

CC1(C)OB(c2ccc(-c3ccc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)cn3)cc2)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.47
LIPG Q9Y5X9 8/20 0.44
LPL P06858 7/20 0.44
ENPP1 P22413 2/20 0.38
ENPP3 O14638 1/20 0.38
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 4/20 0.36
HPGD P15428 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
RAB9A P51151 2/20 0.36
TP53 P04637 3/20 0.34
MAPK1 P28482 3/20 0.34
NPC1 O15118 2/20 0.34
HSD17B10 Q99714 2/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL23075563 0.88 LIPG (0.53) DGAT1LIPGLPLENPP1ENPP3
SCHEMBL22639360 0.87 LIPG (0.55) DGAT1LIPGLPLENPP1ENPP3
SCHEMBL30866396 0.86 LIPG (0.57) DGAT1LIPGLPLENPP1ENPP3
SCHEMBL19794488 0.86 DGAT1 (0.43) DGAT1LIPGLPLPDGFRBKDR
SCHEMBL19106594 0.85 LIPG (0.59) DGAT1LIPGLPLALDH1A1MAPT
SCHEMBL19794477 0.85 LIPG (0.59) DGAT1LIPGLPLALDH1A1MAPT
SCHEMBL18015520 0.83 DGAT1 (0.43) DGAT1LIPGLPLKDM4EALDH1A1
SCHEMBL18015320 0.83 LIPG (0.64) DGAT1LIPGLPLKDM4EALDH1A1
SCHEMBL23964990 0.82 LIPG (0.62) DGAT1LIPGLPLENPP1ENPP3
SCHEMBL18015319 0.82 LIPG (0.56) DGAT1LIPGLPLALDH1A1MAPT

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-11024815-B2 Metal complexes MERCK PATENT GMBH (DE) 2021-06-01 US disclosed
US-20180026209-A1 Metal Complexes MERCK PATENT GMBH (DE) 2018-01-25 US disclosed
US-20180026209-A1 Metal Complexes MERCK PATENT GMBH (DE) 2018-01-25 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 (2 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-11024815-B2 Metal complexes EXOC4, EXOC3, TIMCC DGAT1 1835/4885LIPG 4459/4885LPL 4682/4885
US-20180026209-A1 Metal Complexes AP3M1, AP2M1, SOD1 DGAT1 1328/4885LIPG 3693/4885LPL 3416/4885

“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.