SCHEMBL25507635

SCHEMBL25507635

CN1CCC(N2CCC3(CC2)CC(N2CCC2)C3)CC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
HRH3 Q9Y5N1 11/20 0.40
L3MBTL3 Q96JM7 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
OPRL1 P41146 1/20 0.31
KCNH2 Q12809 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
SCHEMBL24802271 0.89 L3MBTL3 (0.37) ALDH1A1HRH3L3MBTL3L3MBTL1
SCHEMBL24480231 0.87 HRH3 (0.35) ALDH1A1HRH3L3MBTL3L3MBTL1
SCHEMBL26743257 0.84 ALDH1A1 (0.34) ALDH1A1HRH3L3MBTL3L3MBTL1
SCHEMBL24940901 0.84 KDM4E (0.33) HRH3L3MBTL3L3MBTL1KDM4ETDP1
SCHEMBL24480841 0.83 HRH3 (0.37) ALDH1A1HRH3L3MBTL3L3MBTL1KDM4E
SCHEMBL25511877 0.83 HRH3 (0.37) ALDH1A1HRH3L3MBTL3L3MBTL1
SCHEMBL27393320 0.82 OPRL1 (0.33) HRH3L3MBTL3L3MBTL1KDM4ETDP1
SCHEMBL14996489 0.82 ALDH1A1 (0.38) ALDH1A1HRH3L3MBTL3L3MBTL1
SCHEMBL4400116 0.82 ALDH1A1 (0.52) ALDH1A1L3MBTL3L3MBTL1KDM4ETDP1
SCHEMBL26743274 0.81 HRH3 (0.36) ALDH1A1HRH3L3MBTL3L3MBTL1KDM4E

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
EP-4180427-A1 COMPOUND CAPABLE OF INHIBITING AND DEGRADING ANDROGEN RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS AND PHARMACEUTICAL USES THEREOF Sichuan Haisco Pharmaceutical Co., Ltd. (CN) 2023-05-17 EP disclosed