SCHEMBL25856130

SCHEMBL25856130

CC1CCN(C2CCN(CC3CCNCC3)C2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.46
GBA1 P04062 2/20 0.38
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
GNAO1 P09471 1/20 0.34
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
PRMT1 Q99873 1/20 0.32
PRMT8 Q9NR22 1/20 0.32
CACNA2D1 P54289 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNB1 Q02641 1/20 0.31
NPY1R P25929 2/20 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
SCHEMBL29317185 0.90 ACHE (0.44) ACHEGBA1KDM4EPOLBGNAO1
SCHEMBL25027129 0.90 ACHE (0.53) ACHEGBA1KDM4EPOLBGNAO1
SCHEMBL24480695 0.86 ACHE (0.43) ACHEKDM4EPOLBCARM1PRMT6
SCHEMBL25565964 0.83 ACHE (0.50) ACHEGBA1KDM4EGNAO1CARM1
SCHEMBL24718636 0.83 CHRM5 (0.46) ACHEGBA1GNAO1CACNA2D1CACNA1B
SCHEMBL13661595 0.83 ACHE (0.64) ACHEGBA1GNAO1CARM1PRMT6
SCHEMBL24480687 0.83 ACHE (0.47) ACHEKDM4EPOLBCARM1PRMT6
SCHEMBL25027099 0.82 ACHE (0.40) ACHEGBA1KDM4EPOLBGNAO1
Hydrochloric Acid SCHEMBL22033207 0.81 ACHE (0.62) ACHEGBA1GNAO1CARM1PRMT6
SCHEMBL25856132 0.79 ACHE (0.43) ACHEKDM4EPOLBCARM1PRMT6

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-2023131167-A1 COMPOUND FOR INHIBITING AND DEGRADING IRAK4, AND PHARMACEUTICAL COMPOSITION AND PHARMACEUTICAL APPLICATION THEREOF 海思科医药集团股份有限公司 2023-07-13 WO disclosed