SCHEMBL25816391

SCHEMBL25816391

CCC1(CC)CC(Nc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
PKM P14618 1/20 0.51
ALOX15 P16050 1/20 0.51
ALOX12 P18054 1/20 0.51
RAD52 P43351 1/20 0.51
GFER P55789 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
KDM1A O60341 6/20 0.38
MAOA P21397 6/20 0.38
MAOB P27338 6/20 0.38
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
TSHR P16473 2/20 0.33
NFKB1 P19838 1/20 0.33

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
SCHEMBL9372093 0.81 KMT2A (0.61) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL25816545 0.77 MAPT (0.41) ALDH1A1LMNAMAPTL3MBTL1TSHR
SCHEMBL9380274 0.73 KMT2A (0.87) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL19567934 0.73 JAK2 (0.40) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL9002784 0.72 ALDH1A1 (0.54) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL6933221 0.70 KMT2A (0.53) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL6933217 0.70 KMT2A (0.53) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL18832792 0.70 P2RX7 (0.38) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL18832820 0.70 P2RX7 (0.38) MEN1ALDH1A1LMNAMAPTPKM
SCHEMBL3696096 0.69 CARM1 (0.52) MEN1ALDH1A1LMNAMAPTPKM

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-2023130043-A1 MONOACYLGLYCEROL LIPASE INHIBITORS AND USE THEREOF FOR THE TREATMENT OF ANXIETY PSY THERAPEUTICS, INC. (US) 2023-07-06 WO disclosed