SCHEMBL24818783

SCHEMBL24818783

CN1CC[C@@H](Oc2ccc3nc(-c4cccc(-c5ccccc5-c5nncn5C)c4)[nH]c3c2C(F)(F)F)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK2 O96017 1/20 0.35
▸ MET P08581 1/20 0.35
▸ NOS3 P29474 1/20 0.35
▸ NOS1 P29475 1/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ CBLB Q13191 3/20 0.33
▸ CBL P22681 2/20 0.33
▸ HRH4 Q9H3N8 1/20 0.33
▸ KDR P35968 2/20 0.33
▸ SOS1 Q07889 1/20 0.33
▸ PDGFRB P09619 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ UTS2R Q9UKP6 2/20 0.32
▸ USP1 O94782 2/20 0.32
▸ USP8 P40818 2/20 0.32
▸ OTUB1 Q96FW1 2/20 0.32
▸ USP36 Q9P275 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ LCK P06239 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
SCHEMBL30152796 1.00 CHEK2 (0.35) CHEK2METNOS3NOS1NOS2
SCHEMBL24819891 0.85 SCN9A (0.35) CBLBSCN9A
SCHEMBL30152925 0.85 SCN9A (0.35) CBLBSCN9A
SCHEMBL30153349 0.82 ADORA2A (0.39) HRH4
SCHEMBL24821802 0.82 ADORA2A (0.39) HRH4
SCHEMBL24818853 0.81 SCD (0.35) CBLBSCN9A
SCHEMBL30152813 0.81 SCD (0.35) CBLBSCN9A
SCHEMBL24819889 0.80 CBLB (0.35) CBLBCBLSCN9AUSP2
SCHEMBL24819888 0.80 PIM1 (0.36) CBLBCBLSCN9A
SCHEMBL30153255 0.80 CBLB (0.35) CBLBCBLSCN9AUSP2

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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