SCHEMBL5452569

SCHEMBL5452569

CN(C)CCn1c(=O)c2c3cc(OCCOS(C)(=O)=O)ccc3c3c(oc4ccccc4n3C(=O)OC(C)(C)C)c2c1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.34
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
CSF1R P07333 2/20 0.32
KDR P35968 1/20 0.32
SIGMAR1 Q99720 6/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
DYRK1A Q13627 1/20 0.31

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
SCHEMBL5229259 0.91 NR1H2 (0.43) NR1H2CSF1RKDRSIGMAR1L3MBTL1
SCHEMBL5233887 0.84 HTR6 (0.41) SIGMAR1L3MBTL1ALDH1A1MAPT
SCHEMBL5228985 0.78 MAOA (0.35) SIGMAR1BCHEACHE
SCHEMBL5233411 0.77 G6PD (0.40) L3MBTL1KMT2AALDH1A1
SCHEMBL5421563 0.74 SIGMAR1 (0.38) CSF1RKDRSIGMAR1L3MBTL1KMT2A
SCHEMBL5226141 0.68 SIGMAR1 (0.39) SIGMAR1BCHEACHE
SCHEMBL30619908 0.62 NR1H2 (0.50) NR1H2
SCHEMBL5231971 0.61 ALDH1A1 (0.34) SIGMAR1KMT2AALDH1A1HPGD
SCHEMBL5226351 0.59 MPO (0.40) DYRK1A
SCHEMBL27165276 0.59 TOP2A (0.52) SIGMAR1L3MBTL1KMT2AALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312213-B2 Substituted benzo[e][1,4]oxazino[3,2-g]isoindole compounds LES LABORATORIES SERVIER (FR) 2007-12-25 US disclosed
US-20060003997-A1 Substituted benzo[e] [1,4] oxazino [3,2-g] isoindole compounds LES LABORATOIRES SERVIER (FR) 2006-01-05 US 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-20060003997-A1 Substituted benzo[e] [1,4] oxazino [3,2-g] isoindole compounds H1-3, H1-0, H1-2 NR1H2 483/4885CA12 1887/4885CA1 3428/4885

“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.