SCHEMBL30723786

SCHEMBL30723786

O=S(=O)(OC1=C(CC(F)(F)F)CCCc2c1ccc1c2c(F)nn1C1CCCCO1)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.31

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
SCHEMBL30724061 0.84 RXRA (0.36) KMO
SCHEMBL25917442 0.83 CYP4F2 (0.33)
SCHEMBL25918027 0.83 CYP4F2 (0.33)
SCHEMBL30723873 0.81
SCHEMBL25917520 0.78
SCHEMBL30723757 0.78
SCHEMBL30723941 0.76 NPC1 (0.34)
SCHEMBL25917516 0.74 CYP4F2 (0.30)
SCHEMBL24179522 0.73 RET (0.31)
SCHEMBL30723767 0.73 RET (0.31)

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-2024006776-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND MEDICAL USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-01-04 WO disclosed