SCHEMBL6672033

SCHEMBL6672033

Cc1ccc(C(=O)N2C(=O)CCC3CCCCC32)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
CNR2 P34972 1/20 0.41
PKM P14618 2/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL3 Q96JM7 1/20 0.40
EPHX2 P34913 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
GAA P10253 3/20 0.40
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
ABCB1 P08183 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL6674648 0.97 KMT2A (0.41) KMT2AMEN1CNR2PKMALDH1A1
SCHEMBL6670916 0.87 HSD11B1 (0.39) KMT2AMEN1CNR2L3MBTL3GAA
SCHEMBL6673712 0.87 KMT2A (0.42) KMT2AMEN1PKMALDH1A1L3MBTL3
SCHEMBL6673055 0.86 HSD11B1 (0.40) KMT2AMEN1CNR2ALDH1A1L3MBTL3
SCHEMBL6672331 0.86 HSD11B1 (0.49) KMT2ACNR2ALDH1A1EPHX2GAA
SCHEMBL6670959 0.85 KDM4E (0.52) KMT2AMEN1CNR2ALDH1A1EPHX2
SCHEMBL6670907 0.84 HSD11B1 (0.39) KMT2AMEN1CNR2L3MBTL3HPGD
SCHEMBL6669053 0.83 HSD11B1 (0.46) KMT2AMEN1ALDH1A1GAA
SCHEMBL6670611 0.83 HSD11B1 (0.40) KMT2AMEN1CNR2ALDH1A1L3MBTL3
SCHEMBL6670970 0.82 KDM4E (0.52) KMT2AMEN1CNR2ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0713702-B1 ANXIOLYTIC AGENT TAIHO PHARMACEUTICAL CO LTD (JP) 2004-09-29 EP disclosed
US-6355668-B1 ANXIOLYTIC AGENTS; SIDE EFFECT REDUCTION TAIHO PHARMACEUTICAL CO., LTD. (JP) 2002-03-12 US disclosed
US-6303623-B1 TREATING ANXIETY IN A PATIENT IN NEED OF SUCH TREATMENT, COMPRISING ADMINISTERING BICYCLOLACTAM COMPOUND TAIHO PHARMACEUTICAL CO LTD (JP) 2001-10-16 US disclosed
US-6159987-A Bicyclolactam compounds, use thereof and intermediates for preparing thereof TAIHO PHARMACEUTICALS, CO. (JP) 2000-12-12 US disclosed
US-6004975-A ANXIOLYTIC AGENTS WITH SIDE EFFECT REDUCTION TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1999-12-21 US disclosed
EP-0713702-A1 ANXIOLYTIC AGENT TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1996-05-29 EP disclosed