SCHEMBL24671283

SCHEMBL24671283

CNc1ccc2cc(-c3nn(C4CCCCO4)c4c3CC3C(F)(F)C3(C)C4)[nH]c2c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 3/20 0.33
▸ KDR P35968 1/20 0.33
▸ ITK Q08881 4/20 0.31
▸ ABL1 P00519 1/20 0.30

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
SCHEMBL24670121 1.00 RET (0.33) RETKDRITKABL1
SCHEMBL29990667 1.00 RET (0.33) RETKDRITKABL1
SCHEMBL30863352 0.96 RET (0.32) RETKDRITK
SCHEMBL24669945 0.87 RET (0.38) RETKDRITKABL1
SCHEMBL30066213 0.87 RET (0.38) RETKDRITKABL1
SCHEMBL30801213 0.84 ITK (0.37) RETKDRITK
SCHEMBL18812844 0.84 ITK (0.35) RETKDRITKABL1
SCHEMBL30721389 0.84 ITK (0.35) RETKDRITKABL1
SCHEMBL24670748 0.82 ITK (0.31) ITK
SCHEMBL30066236 0.82 ITK (0.31) ITK

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-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 — — WO disclosed
Send feedback