SCHEMBL24818656

SCHEMBL24818656

C[C@@H]1CN(Cc2cc(C(F)(F)F)c3[nH]c(-c4cccc(-c5ccc(F)cc5-c5nncn5C)c4)nc3c2)CCO1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.42
▸ CBLB Q13191 12/20 0.40
▸ CNR1 P21554 1/20 0.38
▸ GRM2 Q14416 5/20 0.38
▸ KCNH2 Q12809 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
SCHEMBL30152828 1.00 CNR2 (0.42) CNR2CBLBCNR1GRM2KCNH2
SCHEMBL24818660 0.89 CBLB (0.42) CNR2CBLB
SCHEMBL30152576 0.89 CBLB (0.42) CNR2CBLB
SCHEMBL30153085 0.86 CBLB (0.36) CNR2CBLBCNR1
SCHEMBL24818860 0.86 CBLB (0.36) CNR2CBLBCNR1
SCHEMBL30153086 0.86 CBLB (0.36) CNR2CBLBCNR1
SCHEMBL24819893 0.86 CBLB (0.40) CNR2CBLBGRM2KCNH2
SCHEMBL24818677 0.86 CBLB (0.40) CNR2CBLBGRM2KCNH2
SCHEMBL29190140 0.85 CNR2 (0.40) CNR2CBLBCNR1GRM2KCNH2
SCHEMBL29190139 0.85 CNR2 (0.40) CNR2CBLBCNR1GRM2KCNH2

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-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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