SCHEMBL25928642

SCHEMBL25928642

CS(=O)(=O)CCCC(=O)c1ccc(OCCN2CCC3(CC2)C(=O)Nc2ccc(Cl)cc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IP6K1 Q92551 8/20 0.45
HRH2 P25021 5/20 0.45
HRH1 P35367 5/20 0.45
IP6K3 Q96PC2 1/20 0.42
IP6K2 Q9UHH9 1/20 0.42
HTR1A P08908 1/20 0.42
HTR2A P28223 1/20 0.42
HTR7 P34969 1/20 0.42
HTR6 P50406 1/20 0.42
DRD2 P14416 3/20 0.42
KCNA5 P22460 2/20 0.42
DRD3 P35462 2/20 0.42

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
SCHEMBL25929422 0.88 IP6K1 (0.49) IP6K1HRH2HRH1IP6K3IP6K2
SCHEMBL30507140 0.86 HTR7 (0.40) IP6K1HTR1AHTR2AHTR7HTR6
SCHEMBL25318150 0.86 HTR7 (0.40) IP6K1HTR1AHTR2AHTR7HTR6
SCHEMBL30507360 0.83 IP6K1 (0.61) IP6K1IP6K3IP6K2HTR1AHTR2A
SCHEMBL25316705 0.83 IP6K1 (0.61) IP6K1IP6K3IP6K2HTR1AHTR2A
SCHEMBL30506835 0.82 HTR1A (0.44) IP6K1IP6K3IP6K2HTR1AHTR2A
SCHEMBL25315499 0.82 HTR1A (0.44) IP6K1IP6K3IP6K2HTR1AHTR2A
SCHEMBL25316240 0.82 IP6K1 (0.63) IP6K1IP6K3IP6K2HTR1AHTR2A
SCHEMBL30507031 0.82 IP6K1 (0.63) IP6K1IP6K3IP6K2HTR1AHTR2A
SCHEMBL25317326 0.82 HTR7 (0.44) IP6K1HTR1AHTR2AHTR7HTR6

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
WO-2023141432-A2 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2023-07-27 WO disclosed