SCHEMBL29190071

SCHEMBL29190071

Cn1cnnc1-c1cc(F)ccc1-c1cc(-c2nc3cc(CNC4CCC[C@H]4O)cc(C(F)(F)F)c3o2)nc(C2CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 2/20 0.41
▸ TRPV3 Q8NET8 7/20 0.32
▸ RAF1 P04049 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
SCHEMBL29190069 1.00 CBLB (0.41) CBLBTRPV3RAF1
SCHEMBL24819905 1.00 CBLB (0.41) CBLBTRPV3RAF1
SCHEMBL30152916 1.00 CBLB (0.41) CBLBTRPV3RAF1
SCHEMBL31579000 0.94 CBLB (0.38) CBLB
SCHEMBL30153126 0.92 CBLB (0.35) CBLBTRPV3
SCHEMBL24820270 0.92 CBLB (0.35) CBLBTRPV3
SCHEMBL24819009 0.92 CBLB (0.35) CBLBTRPV3
SCHEMBL24820102 0.92 CBLB (0.35) CBLBRAF1
SCHEMBL30152688 0.92 CBLB (0.35) CBLBTRPV3
SCHEMBL30153020 0.92 CBLB (0.35) CBLBRAF1

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
CN-117858865-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 — — CN disclosed
Send feedback