SCHEMBL28934869

SCHEMBL28934869

CCOC(=O)C1(C)C2CN(Cc3ccccc3)CC21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
LMNA P02545 3/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
OPRM1 P35372 2/20 0.48
OPRD1 P41143 2/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
POLB P06746 1/20 0.48
GAA P10253 2/20 0.47
KDM4E B2RXH2 2/20 0.47
S1PR1 P21453 1/20 0.47
S1PR5 Q9H228 1/20 0.47
HTT P42858 1/20 0.46
ATM Q13315 1/20 0.46
OPRK1 P41145 1/20 0.46

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
SCHEMBL21828677 0.86 CYP3A4 (0.51) CYP3A4CYP2D6CYP2C9CYP2C19LMNA
SCHEMBL21828678 0.86 CYP3A4 (0.51) CYP3A4CYP2D6CYP2C9CYP2C19LMNA
SCHEMBL3974425 0.79 CYP3A4 (0.49) CYP3A4CYP2D6CYP2C9CYP2C19LMNA
SCHEMBL10306089 0.79 CYP3A4 (0.49) CYP3A4CYP2D6CYP2C9CYP2C19LMNA
SCHEMBL928913 0.78 CYP3A4 (0.51) CYP3A4CYP2D6CYP2C9CYP2C19LMNA
SCHEMBL14037432 0.78 USP30 (0.62) ALDH1A1L3MBTL1KDM4ES1PR1S1PR5
SCHEMBL1872029 0.78 L3MBTL1 (0.65) ALDH1A1SMN1; SMN2L3MBTL1KDM4ES1PR1
SCHEMBL13177349 0.78 USP30 (0.62) ALDH1A1L3MBTL1KDM4ES1PR1S1PR5
SCHEMBL1055082 0.78 USP30 (0.62) ALDH1A1L3MBTL1KDM4ES1PR1S1PR5
SCHEMBL853540 0.78 USP30 (0.62) ALDH1A1L3MBTL1KDM4ES1PR1S1PR5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4471027-A1 3-AZABICYCLO(3.1.0)HEXANE DERIVATIVES HAVING KDM5 INHIBITORY ACTIVITY AND USE THEREOF ONO Pharmaceutical Co., Ltd. (JP) 2024-12-04 EP disclosed
CN-115461338-B 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof 小野药品工业株式会社 2024-02-20 CN disclosed
EP-4146645-A1 3-AZABICYCLO(3.1.0)HEXANE DERIVATIVES HAVING KDM5 INHIBITORY ACTIVITY AND USE THEREOF ONO Pharmaceutical Co., Ltd. (JP) 2023-03-15 EP disclosed
CN-115461338-A 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof 小野药品工业株式会社 2022-12-09 CN disclosed