SCHEMBL22567052

SCHEMBL22567052

CC1(C)OB(c2cc(-c3ccccc3-c3ccc(-c4ncc(-c5ccccc5)c5ccccc45)cc3)cc(-c3ccccc3-c3ccc(-c4ncc(-c5ccccc5)c5ccccc45)cc3)c2)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 8/20 0.47
LPL P06858 7/20 0.47
PDGFRB P09619 3/20 0.41
KDR P35968 3/20 0.41
DGAT1 O75907 1/20 0.38
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
ADORA1 P30542 2/20 0.31
ADORA2A P29274 2/20 0.31
CYP17A1 P05093 1/20 0.31
ALPL P05186 1/20 0.31
P4HB P07237 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL17177947 0.83 LIPG (0.61) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL31720865 0.82 LIPG (0.65) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL19794357 0.81 LIPG (0.46) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL19933638 0.80 LIPG (0.46) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL19794354 0.79 DGAT1 (0.53) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL29626026 0.78 LIPG (0.55) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL20696474 0.77 LIPG (0.43) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL23487532 0.77 LIPG (0.54) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL22947717 0.77 LIPG (0.50) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL21397945 0.77 LIPG (0.45) LIPGLPLPDGFRBKDRDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220209141-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2022-06-30 US disclosed
WO-2020212296-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-10-22 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-20220209141-A1 METAL COMPLEXES AP1M1, SOD1, AP3M1 LIPG 3289/4885LPL 3220/4885PDGFRB 4872/4885

“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.