SCHEMBL8569428

SCHEMBL8569428

CC(C)(C)OC(=O)c1c(C(=O)N2CCCC2)c2cncn2c2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.39
PIM1 P11309 1/20 0.39
MARK3 P27448 1/20 0.39
MAP4K2 Q12851 1/20 0.39
CAMK2B Q13554 1/20 0.39
PIM3 Q86V86 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TACR1 P25103 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
AVPR1B P47901 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PTK2 Q05397 1/20 0.35
HPGD P15428 2/20 0.35

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
SCHEMBL8597724 0.83 REN (0.41) CNR2ALDH1A1SMN1; SMN2TACR1MEN1
SCHEMBL7332980 0.78 GABRA1 (0.40) CNR2ALDH1A1AVPR1BMEN1KMT2A
SCHEMBL9376187 0.67 LCK (0.54) PTK2
SCHEMBL367564 0.66 HPGD (0.50) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL7337972 0.66 GABRA1 (0.38) HPGD
SCHEMBL365591 0.65 HPGD (0.49) CNR2ALDH1A1SMN1; SMN2L3MBTL1MEN1
SCHEMBL7334082 0.64 GABRA1 (0.37)
SCHEMBL28091998 0.64 ALDH1A1 (0.52) ALDH1A1L3MBTL1MEN1KMT2AHPGD
SCHEMBL28327200 0.64 EGFR (0.44) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL14463536 0.63 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2TACR1MEN1KMT2A

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-0729469-B1 IMIDAZO [1,5-a]QUINOLINES FOR TREATMENT OF ANXIETY AND SLEEP DISORDERS UPJOHN CO (US) 1998-09-23 EP claimed