SCHEMBL25565964

SCHEMBL25565964

CC1CCN(CC2CCNCC2)C1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.50
GBA1 P04062 2/20 0.44
GNAO1 P09471 5/20 0.39
CACNA2D1 P54289 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNB1 Q02641 1/20 0.35
GNAI3 P08754 4/20 0.34
GNAI1 P63096 4/20 0.34
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT1 Q99873 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
CHRM5 P08912 1/20 0.33
ADRA2C P18825 1/20 0.33
HTR4 Q13639 1/20 0.32
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL24716276 0.90 ACHE (0.54) ACHEGBA1GNAO1CACNA2D1CACNA1B
SCHEMBL19560910 0.89 ACHE (0.43) ACHEGBA1GNAO1CARM1PRMT6
SCHEMBL13661316 0.89 ACHE (0.43) ACHEGBA1GNAO1CHRM5ADRA2C
SCHEMBL25477588 0.89 ACHE (0.43) ACHEGBA1GNAO1CARM1PRMT6
SCHEMBL13661595 0.88 ACHE (0.64) ACHEGBA1GNAO1CACNA2D1CACNA1B
Hydrochloric Acid SCHEMBL22033207 0.86 ACHE (0.62) ACHEGBA1GNAO1CACNA2D1CACNA1B
SCHEMBL21946274 0.86 GBA1 (0.56) ACHEGBA1GNAO1CACNA2D1CACNA1B
SCHEMBL10130156 0.86 ACHE (0.59) ACHECARM1PRMT6PRMT1PRMT8
SCHEMBL10130194 0.86 ACHE (0.59) ACHECARM1PRMT6PRMT1PRMT8
SCHEMBL478539 0.86 ACHE (0.59) ACHECARM1PRMT6PRMT1PRMT8

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 2 patents. 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
WO-2023083194-A1 WEE1 PROTEIN KINASE DEGRADATION AGENT AND USE THEREOF 杭州格博生物医药有限公司 2023-05-19 WO disclosed