SCHEMBL7606447

SCHEMBL7606447

COc1cccc(C(=O)N2C(=O)CCC3C(=O)CCC32)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
SRD5A1 P18405 2/20 0.45
ALDH1A1 P00352 1/20 0.44
HSD11B1 P28845 2/20 0.44
MGLL Q99685 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
KMT2A Q03164 3/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GFER P55789 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PARP1 P09874 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL7604786 0.88 ALDH1A1 (0.45) L3MBTL1SRD5A1ALDH1A1KMT2ATSHR
SCHEMBL7605171 0.85 KDM4E (0.48) L3MBTL1SRD5A1ALDH1A1HSD11B1MGLL
SCHEMBL7605165 0.83 TSHR (0.48) L3MBTL1ALDH1A1KMT2ATSHRSMN1; SMN2
SCHEMBL7610469 0.81 SMYD3 (0.40) L3MBTL1MGLLSMN1; SMN2PARP1
SCHEMBL7605220 0.81 SMN1; SMN2 (0.44) L3MBTL1SRD5A1ALDH1A1SMN1; SMN2MAPT
SCHEMBL7604509 0.81 SRD5A1 (0.44) SRD5A1ALDH1A1HSD11B1KMT2ATSHR
SCHEMBL7604229 0.80 MAPK1 (0.50) ALDH1A1HSD11B1KMT2ASMN1; SMN2POLB
SCHEMBL7607861 0.80 KMT2A (0.49) L3MBTL1ALDH1A1KMT2ASMN1; SMN2POLB
SCHEMBL7605167 0.76 KMT2A (0.40) SRD5A1ALDH1A1HSD11B1MGLLKMT2A
SCHEMBL7605169 0.76 KMT2A (0.40) SRD5A1ALDH1A1HSD11B1MGLLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6500819-B2 HAS AN EXCELLENT ANXIOLYTIC EFFECT TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 2002-12-31 US disclosed
EP-0790237-B1 BICYCLOLACTAM COMPOUNDS, USE OF THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2002-09-18 EP disclosed
US-20020099048-A1 Bicycloloactam compounds, use thereof and intermediates for preparing thereof TAIHO PHARMACEUTICAL COMPANY LIMITED 2002-07-25 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-0790237-A1 BICYCLOLACTAM COMPOUNDS, USE OF THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE SAME TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-08-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020099048-A1 Bicycloloactam compounds, use thereof and intermediates for preparing thereof CYP11B1, GABRA6, CYP11B2 L3MBTL1 1471/4885SRD5A1 913/4885ALDH1A1 304/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.