SCHEMBL23487533

SCHEMBL23487533

CC1(C)OB(c2cc(-c3ccccc3-c3cnc4ccccc4c3)cc(-c3ccccc3-c3cnc4ccccc4c3)c2)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.47
LIPG Q9Y5X9 2/20 0.47
ALPL P05186 1/20 0.44
CYP2A6 P11509 1/20 0.43
PDGFRB P09619 4/20 0.41
PDGFRA P16234 3/20 0.41
BRD4 O60885 2/20 0.41
CREBBP Q92793 2/20 0.41
BIRC5 O15392 1/20 0.39
KDR P35968 1/20 0.39
CYP1A2 P05177 1/20 0.39
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
NR2F2 P24468 1/20 0.38
MAP4K4 O95819 1/20 0.38
CSNK1G2 P78368 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
MAP4K5 Q9Y4K4 1/20 0.38
AKR1C3 P42330 2/20 0.37

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
SCHEMBL29831910 0.91 LPL (0.50) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL29847497 0.91 LPL (0.50) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL19106677 0.91 LPL (0.50) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL19933832 0.83 LPL (0.46) LPLLIPGALPLPDGFRBPDGFRA
SCHEMBL1825954 0.83 LPL (0.65) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL167417 0.81 ALPL (0.57) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL19106599 0.81 LPL (0.58) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL12731574 0.80 DGAT1 (0.53) LPLLIPGALPLCYP2A6PDGFRB
SCHEMBL23487532 0.77 LIPG (0.54) LPLLIPGPDGFRBKDRMKNK2
SCHEMBL17177947 0.77 LIPG (0.61) LPLLIPGPDGFRBKDR

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-20230056324-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2023-02-23 US disclosed
WO-2021110720-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-06-10 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-20230056324-A1 METAL COMPLEXES MCU, IMMT, SOD1 LPL 4205/4885LIPG 3736/4885ALPL 651/4885

“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.