SCHEMBL6674664

SCHEMBL6674664

COc1ccc(C(=O)N2CC3CCCC3CC2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
MAPT P10636 1/20 0.56
THRB P10828 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
RECQL P46063 1/20 0.56
BLM P54132 1/20 0.56
KMT2A Q03164 1/20 0.56
CHRNB2 P17787 2/20 0.48
CHRNB4 P30926 2/20 0.48
CHRNA3 P32297 2/20 0.48
CHRNA7 P36544 2/20 0.48
CHRNA4 P43681 2/20 0.48
HPGD P15428 2/20 0.48
SIRT3 Q9NTG7 1/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 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
SCHEMBL6673957 0.97 KDM4E (0.56) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL6674228 0.88 KDM4E (0.61) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL6671084 0.86 KDM4E (0.61) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL7652369 0.85 KDM4E (0.60) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL6671710 0.82 KDM4E (0.52) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL11091586 0.81 KMT2A (0.57) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL11091580 0.81 KMT2A (0.57) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL11091576 0.81 KMT2A (0.57) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL6669032 0.80 KDM4E (0.50) KDM4EMEN1CYP1A2CYP2D6MAPT
SCHEMBL7608308 0.79 KDM4E (0.56) KDM4EMEN1CYP1A2CYP2D6MAPT

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 7 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-6500819-B2 HAS AN EXCELLENT ANXIOLYTIC EFFECT TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 2002-12-31 US 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