SCHEMBL30965693

SCHEMBL30965693

O=C(NC1CC2(CCN(CCC3CCN(c4cc(F)c([N+](=O)[O-])cc4F)CC3)CC2)C1)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
HTR2A P28223 1/20 0.44
CHRM4 P08173 4/20 0.42
ENPP2 Q13822 1/20 0.38
ATXN2 Q99700 1/20 0.38
TMEM97 Q5BJF2 3/20 0.37
GPR174 Q9BXC1 2/20 0.37
RORC P51449 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSK P43235 1/20 0.37
FAAH O00519 1/20 0.37
ACHE P22303 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
DPP4 P27487 1/20 0.36
KCNH2 Q12809 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
F13A1 P00488 1/20 0.36

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
SCHEMBL30965812 0.93 CHRM4 (0.39) HTR1ADRD2HTR2ACHRM4ENPP2
SCHEMBL30965559 0.91 CHRM4 (0.51) HTR1ADRD2HTR2ACHRM4TMEM97
SCHEMBL30965765 0.90 MAPT (0.44) HTR1ADRD2HTR2ACHRM4ENPP2
SCHEMBL30965716 0.89 HTR1A (0.45) HTR1ADRD2HTR2ACHRM4ENPP2
SCHEMBL30965750 0.86 POLB (0.42) CHRM4ENPP2ATXN2GPR174FAAH
SCHEMBL30965635 0.83 CHRM4 (0.48) HTR1ADRD2HTR2ACHRM4FAAH
SCHEMBL30135712 0.83 MAPT (0.45) CHRM4ENPP2ATXN2CTSLCTSB
SCHEMBL30965749 0.81 CHRM4 (0.50) HTR1ADRD2HTR2ACHRM4ACHE
SCHEMBL30965545 0.81 DPP4 (0.40) HTR1ADRD2HTR2ACHRM4ENPP2
SCHEMBL30135724 0.81 ENPP2 (0.40) HTR1ADRD2HTR2ACHRM4ENPP2

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
EP-4658658-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND Uppthera, Inc. (KR) 2025-12-10 EP disclosed
WO-2024162828-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2024-08-08 WO disclosed