SCHEMBL24320055

SCHEMBL24320055

CC1(N2CCN(CC3CCN(CCC4(N5CCN(CC6CCNCC6)CC5)CC4)CC3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 4/20 0.37
CACNA2D1 P54289 1/20 0.32
CACNA1B Q00975 1/20 0.32
CACNB1 Q02641 1/20 0.32
GNAI3 P08754 3/20 0.31
GNAI1 P63096 3/20 0.31
GBA1 P04062 1/20 0.30
ACHE P22303 1/20 0.30
HTR4 Q13639 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
SCHEMBL24319650 0.79 CACNA2D1 (0.37) GNAO1CACNA2D1CACNA1BCACNB1GBA1
SCHEMBL24319188 0.74 NCF1 (0.41) CACNA2D1CACNA1BCACNB1ACHE
SCHEMBL24319365 0.72 CACNA2D1 (0.36) GNAO1CACNA2D1CACNA1BCACNB1GBA1
SCHEMBL14422030 0.70 GBA1 (0.48) GNAO1CACNA2D1CACNA1BCACNB1GNAI3
SCHEMBL17257630 0.69 GNAO1 (0.50) GNAO1CACNA2D1CACNA1BCACNB1GNAI3
SCHEMBL24319495 0.69
SCHEMBL2794883 0.69 CACNA2D1 (0.42) GNAO1CACNA2D1CACNA1BCACNB1GNAI3
SCHEMBL24319651 0.68 NCF1 (0.38) CACNA2D1CACNA1BCACNB1ACHE
SCHEMBL24319174 0.68 ACHE (0.38) GNAO1CACNA2D1CACNA1BCACNB1GNAI3
Hydrochloric Acid SCHEMBL5573130 0.68 GBA1 (0.47) GNAO1CACNA2D1CACNA1BCACNB1GNAI3

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-2022047145-A1 RAPIDLY ACCELERATING FIBROSARCOMA PROTEIN DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-03-03 WO disclosed