SCHEMBL7605872

SCHEMBL7605872

CC(=O)OC1CCC2C(=O)N(C(=O)c3ccc(F)cc3)CCC12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
HSD11B1 P28845 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LIPE Q05469 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
ATM Q13315 1/20 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
SCHEMBL7611174 0.89 KMT2A (0.41) ALDH1A1HSD11B1SMN1; SMN2LMNAKDM4E
SCHEMBL7610167 0.88 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL7606287 0.87 KMT2A (0.50) ALDH1A1HSD11B1SMN1; SMN2LMNAKDM4E
SCHEMBL7609510 0.81 ALDH1A1 (0.46) ALDH1A1HSD11B1SMN1; SMN2KDM4EMEN1
SCHEMBL7606000 0.80 ALDH1A1 (0.46) ALDH1A1HSD11B1KMT2ARAB9ANPC1
SCHEMBL7612715 0.74 HSD11B1 (0.38) ALDH1A1HSD11B1SMN1; SMN2LMNAKDM4E
SCHEMBL7609548 0.71 KMT2A (0.43) ALDH1A1HSD11B1SMN1; SMN2HPGDMEN1
SCHEMBL7604779 0.71 KMT2A (0.50) ALDH1A1HSD11B1SMN1; SMN2LMNAKDM4E
SCHEMBL7611917 0.70 NAAA (0.42) ALDH1A1SMN1; SMN2HPGDKMT2ARAB9A
SCHEMBL7611724 0.70 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2RAB9ANPC1

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
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-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 ALDH1A1 304/4885HSD11B1 265/4885SMN1; SMN2 629/4885

“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.