SCHEMBL25075230

SCHEMBL25075230

CC(C)C(=O)N1CCC(CCC2CCN(C)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.51
GNAO1 P09471 1/20 0.51
GNAI1 P63096 1/20 0.51
FAAH O00519 1/20 0.47
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NCF1 P14598 1/20 0.39
RORC P51449 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
EPHX2 P34913 2/20 0.39
CHRNB2 P17787 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
CHRNB3 Q05901 1/20 0.38
CHRNA6 Q15825 1/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 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
SCHEMBL25075232 0.84 FAAH (0.47) GNAI3GNAO1GNAI1FAAHALDH1A1
SCHEMBL26295520 0.84 FAAH (0.46) GNAI3GNAO1GNAI1FAAHALDH1A1
SCHEMBL25737219 0.84 FAAH (0.48) FAAHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL18513691 0.84 FAAH (0.48) GNAI3GNAO1GNAI1FAAHALDH1A1
SCHEMBL12413671 0.82 FAAH (0.47) FAAHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL26203835 0.82 FAAH (0.47) FAAHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL26263451 0.81 CACNA2D1 (0.48) FAAHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL26224205 0.81 FAAH (0.52) GNAI3GNAO1GNAI1FAAHALDH1A1
SCHEMBL25924562 0.80 FAAH (0.45) FAAHALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1753627 0.79 EPHX2 (0.53) FAAHALDH1A1MEN1KMT2AL3MBTL1

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-2023023537-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. (US) 2023-02-23 WO disclosed