SCHEMBL24185486

SCHEMBL24185486

CC1CCN(C2CC3(CCN(C4CC5(CCNCC5)C4)CC3)C2)CC1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.33
L3MBTL3 Q96JM7 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 2/20 0.31
USP2 O75604 1/20 0.31
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 2/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL25507466 0.90 HRH3 (0.31) HRH3
SCHEMBL22737182 0.89 CYP1A2 (0.33) HRH3L3MBTL3L3MBTL1CYP1A2CYP2D6
SCHEMBL25856032 0.87 L3MBTL3 (0.33) HRH3L3MBTL3L3MBTL1CYP1A2TSHR
SCHEMBL24185483 0.86 TSHR (0.33) HRH3CYP1A2CYP2D6USP2TSHR
SCHEMBL19370306 0.83 CYP2D6 (0.39) HRH3L3MBTL3L3MBTL1CYP1A2CYP2D6
SCHEMBL25814798 0.83 CYP1A2 (0.33) HRH3L3MBTL3L3MBTL1CYP1A2
SCHEMBL25518058 0.83 HRH3 (0.34) HRH3L3MBTL3L3MBTL1
SCHEMBL26752530 0.83 HRH3 (0.33) HRH3
SCHEMBL25508404 0.82 HRH3 (0.33) HRH3KDM4EPOLB
SCHEMBL26748933 0.82 HRH3 (0.34) HRH3L3MBTL3L3MBTL1CYP1A2

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 3 patents. 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
WO-2022111526-A1 BENZENE RING DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 四川海思科制药有限公司 2022-06-02 WO disclosed
WO-2022007903-A1 COMPOUND CAPABLE OF INHIBITING AND DEGRADING ANDROGEN RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS AND PHARMACEUTICAL USES THEREOF 四川海思科制药有限公司 2022-01-13 WO disclosed