SCHEMBL25819578

SCHEMBL25819578

Cc1ccc(-c2cccc(N3CCC(CO)CC3)c2)c(OCc2ccccc2)n1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.45
HTR1D P28221 11/20 0.45
HTR1B P28222 11/20 0.45
LRRK2 Q5S007 2/20 0.43
PDE10A Q9Y233 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
HTR7 P34969 2/20 0.38
HIF1A Q16665 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
SCHEMBL25482345 0.90 LRRK2 (0.43) HTR1AHTR1DHTR1BLRRK2GABRA1
SCHEMBL25666759 0.90 LRRK2 (0.44) HTR1AHTR1DHTR1BLRRK2PDE10A
SCHEMBL25819577 0.86 HTR1A (0.41) HTR1AHTR1DHTR1BGABRG2GABRB3
SCHEMBL25819437 0.85 FFAR4 (0.39) LRRK2PDE10A
SCHEMBL25935366 0.85 LRRK2 (0.46) HTR1AHTR1DHTR1BLRRK2
SCHEMBL25819581 0.84 MAPT (0.51)
SCHEMBL25935028 0.84 FFAR4 (0.49) LRRK2PDE10A
SCHEMBL25935109 0.83 FFAR4 (0.50)
SCHEMBL25482314 0.83 DGAT1 (0.43) LRRK2PDE10A
SCHEMBL25935357 0.83 ITGB2 (0.39) LRRK2HTR7

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-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 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-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND PLK1, BUB1B, BUB1 HTR1A 4156/4885HTR1D 4288/4885HTR1B 4222/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 HTR1A 2866/4885HTR1D 3081/4885HTR1B 3067/4885

“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.