SCHEMBL26705237

SCHEMBL26705237

O=C(OC1C2CCC(CC2)C1OC(=O)c1ccc2ccccc2c1)c1ccc2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
LGALS9 O00182 1/20 0.49
LGALS8 O00214 1/20 0.49
LGALS1 P09382 1/20 0.49
LGALS3 P17931 1/20 0.49
LGALS7; LGALS7B P47929 1/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
BCHE P06276 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
EGFR P00533 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45

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
SCHEMBL24278620 0.85 BCHE (0.46) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL24278827 0.84 LGALS9 (0.43) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL26705642 0.80 CHRNA7 (0.53) MEN1KMT2ALMNA
SCHEMBL27138259 0.80 CHRNA7 (0.53) MEN1KMT2ALMNA
SCHEMBL11067038 0.80 HRH3 (0.52) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL24278810 0.80 CES2 (0.45) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL24278717 0.80 SLC6A4 (0.45) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL27105762 0.80 CES2 (0.45) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL27105248 0.80 CES2 (0.52) CES2CES1LGALS9LGALS8LGALS1
SCHEMBL24278705 0.80 BCHE (0.42) CES2CES1LGALS9LGALS8LGALS1

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
US-20240067764-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2024-02-29 US disclosed
US-20240067764-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2024-02-29 US disclosed
US-20240067597-A1 ESTER COMPOUND MITSUI CHEMICALS, INC. (JP) 2024-02-29 US disclosed
US-20240067597-A1 ESTER COMPOUND MITSUI CHEMICALS, INC. (JP) 2024-02-29 US disclosed
EP-4269450-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER Mitsui Chemicals, Inc. (JP) 2023-11-01 EP disclosed
EP-4265593-A1 ESTER COMPOUND Mitsui Chemicals, Inc. (JP) 2023-10-25 EP 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-20240067597-A1 ESTER COMPOUND PPT1, GPER1, TCP1 CES2 105/4885CES1 65/4885LGALS9 3655/4885

“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.