SCHEMBL27267682

SCHEMBL27267682

CCN1CCC(N2CCC3(CCN(C)CC3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.34
CHRM2 P08172 1/20 0.33
CHRM3 P20309 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
TLR9 Q9NR96 2/20 0.32
TLR7 Q9NYK1 2/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
ACHE P22303 1/20 0.32
TSHR P16473 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
SCHEMBL13168226 0.93 KMT2A (0.39) KMT2ASMN1; SMN2HRH3GNAI3GNAO1
SCHEMBL24480413 0.88 KMT2A (0.33) KMT2ASMN1; SMN2CHRM2CHRM3HRH3
SCHEMBL27289186 0.88 KMT2A (0.38) KMT2ATLR9TLR7ACHE
SCHEMBL2633463 0.85 KMT2A (0.39) KMT2ASMN1; SMN2HRH3ACHETSHR
SCHEMBL14996489 0.85 ALDH1A1 (0.38) SMN1; SMN2HRH3TSHR
SCHEMBL27291235 0.84 KMT2A (0.41) KMT2ASMN1; SMN2TLR9TLR7ACHE
SCHEMBL24481348 0.84 TSHR (0.33) TSHR
SCHEMBL24480850 0.84 TSHR (0.32) CHRM2CHRM3TSHR
SCHEMBL23269619 0.83 KMT2A (0.51) KMT2ASMN1; SMN2GNAI3GNAO1GNAI1
SCHEMBL1160925 0.83 KMT2A (0.51) KMT2ASMN1; SMN2HRH3GNAI3GNAO1

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-2024112692-A1 CASITAS B-LINEAGE LYMPHOMA PROTOONCOGENE B (CBL-B) DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-05-30 WO disclosed