SCHEMBL4167380

SCHEMBL4167380

CN1C(=O)COc2ccc(C(=O)CCl)cc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
MAPT P10636 2/20 0.53
USP30 Q70CQ3 1/20 0.49
PTGER3 P43115 1/20 0.47
CBX7 O95931 2/20 0.44
CDYL2 Q8N8U2 2/20 0.44
CDYL Q9Y232 2/20 0.44
CDY1; CDY1B Q9Y6F8 2/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
KMO O15229 1/20 0.44
TSHR P16473 3/20 0.44
GAA P10253 1/20 0.44
USP2 O75604 2/20 0.44
HTT P42858 2/20 0.43
ATM Q13315 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PLK1 P53350 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 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
SCHEMBL10854210 0.88 ATM (0.52) ALDH1A1MAPTUSP30PTGER3CBX7
SCHEMBL3217163 0.83 LMNA (0.54) ALDH1A1MAPTUSP30PTGER3PDE3B
SCHEMBL1119881 0.83 PTGER3 (0.51) MAPTUSP30PTGER3PDE3BPDE3A
SCHEMBL7343831 0.81 USP30 (0.48) ALDH1A1USP30PTGER3CBX7CDYL2
SCHEMBL3213901 0.80 SMN1; SMN2 (0.56) ALDH1A1USP30PTGER3PDE3BPDE3A
SCHEMBL14565021 0.78 ALDH1A1 (0.51) ALDH1A1MAPTUSP30PTGER3CBX7
SCHEMBL474625 0.78 PTGER3 (0.42) ALDH1A1MAPTUSP30PTGER3CBX7
SCHEMBL9197069 0.77 PDE3B (0.48) USP30PDE3BPDE3AKMOTSHR
SCHEMBL14423522 0.77 PTGER3 (0.45) ALDH1A1MAPTUSP30PTGER3PDE3B
SCHEMBL474378 0.77 CBX7 (0.46) ALDH1A1MAPTUSP30PTGER3CBX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090076274-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED 2009-03-19 US disclosed
US-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders GLAXO GROUP LIMITED (GB) 2006-11-23 US disclosed
EP-1562917-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2005-08-17 EP disclosed
WO-2004046124-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2004-06-03 WO 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 (2 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-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders XDH, CYP4X1, PDHX ALDH1A1 313/4885MAPT 2057/4885USP30 2692/4885
US-20090076274-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS XDH, CYP4X1, PDHX ALDH1A1 736/4885MAPT 1924/4885USP30 2392/4885

“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.