SCHEMBL31584022

SCHEMBL31584022

COC(=O)c1ccc(C2CCNCC2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.50
TLR8 Q9NR97 1/20 0.50
QDPR P09417 1/20 0.45
HTR2C P28335 7/20 0.44
PLAT P00750 2/20 0.43
P2RX7 Q99572 1/20 0.39
USP25 Q9UHP3 1/20 0.39
CHEK1 O14757 1/20 0.38

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
Hydrochloric Acid SCHEMBL31583580 0.99 TLR9 (0.49) TLR9TLR8QDPRHTR2CPLAT
SCHEMBL15778750 0.90 SLC6A3 (0.44) TLR9TLR8
SCHEMBL25953850 0.90 SLC6A3 (0.44) TLR9TLR8
SCHEMBL3867583 0.89 TLR9 (0.50) TLR9TLR8QDPRHTR2CPLAT
Hydrochloric Acid SCHEMBL3167799 0.88 TLR9 (0.49) TLR9TLR8QDPRHTR2CPLAT
SCHEMBL13544329 0.87 ACMSD (0.45)
SCHEMBL3903392 0.86 ACMSD (0.47)
SCHEMBL31385923 0.85 HTR2A (0.49)
SCHEMBL16991978 0.83 HTR2C (0.48) TLR9TLR8QDPRHTR2CPLAT
SCHEMBL16070837 0.83 PDE4A (0.44) TLR9TLR8

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-2025106910-A1 DEGRADER MOLECULES TARGETING ANDROGEN RECEPTOR FLARE THERAPEUTICS INC. (US) 2025-05-22 WO disclosed