SCHEMBL25935357

SCHEMBL25935357

COc1cc(-c2ccc(C)nc2OCc2ccccc2)ccc1N1CCC(CO)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
SMPD3 Q9NY59 2/20 0.38
LRRK2 Q5S007 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
EHMT2 Q96KQ7 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTR7 P34969 1/20 0.37
ACHE P22303 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
ERN1 O75460 1/20 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
SCHEMBL25940006 0.92 ITGB2 (0.38) ITGB2ICAM1ITGALLRRK2FFAR4
SCHEMBL30479018 0.92 ITGB2 (0.38) ITGB2ICAM1ITGALLRRK2FFAR4
SCHEMBL25819437 0.90 FFAR4 (0.39) LRRK2FFAR4
SCHEMBL25935028 0.88 FFAR4 (0.49) LRRK2FFAR4
SCHEMBL25935354 0.85 HPGD (0.50) MAPTMAPK1
SCHEMBL25666759 0.85 LRRK2 (0.44) LRRK2MAPT
SCHEMBL25935366 0.83 LRRK2 (0.46) LRRK2EHMT2MAPTMAPK1
SCHEMBL25819578 0.83 HTR1A (0.45) LRRK2HTR7
SCHEMBL25034764 0.83 GRM5 (0.38) LRRK2FFAR4
SCHEMBL30475431 0.83 GRM5 (0.38) LRRK2FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242541-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-08-03 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 (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-20230242541-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND PLK1, BUB1B, BUB1 ITGB2 4302/4885ICAM1 3310/4885ITGAL 4692/4885

“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.