SCHEMBL3093728

SCHEMBL3093728

COC(=O)C1=C(N)CC(O)(C(=O)OC)C=C1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CFTR P13569 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL6246857 0.78 ALDH1A1 (0.31) ALDH1A1CFTRHSD17B10
SCHEMBL5327853 0.72
SCHEMBL13780268 0.70 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4022918 0.69
SCHEMBL3348005 0.67 POLB (0.32) ALDH1A1HSD17B10
SCHEMBL6752183 0.67 MEN1 (0.30)
SCHEMBL28648656 0.66 MEN1 (0.36) ALDH1A1HSD17B10CA1CA2
SCHEMBL4822508 0.66 MEN1 (0.30) HSD17B10
SCHEMBL31543060 0.62
SCHEMBL31430625 0.62 CA12 (0.32) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799913-B2 Carbonylbenzoxazine compounds for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2010-09-21 US disclosed
CN-1620440-A Carbonylbenzoxazine compounds for enhancing glutamatergic synaptic responses CORTEX PHARMA INC (US) 2005-05-25 CN disclosed
EP-1448537-A4 CARBONYLBENZOXAZINE COMPOUNDS FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES CORTEX PHARMA INC (US) 2005-05-04 EP disclosed
US-20040259871-A1 Carbonylbenzoxazine compounds for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC 2004-12-23 US disclosed
EP-1448537-A2 CARBONYLBENZOXAZINE COMPOUNDS FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES CORTEX PHARMACEUTICALS, INC. (US) 2004-08-25 EP disclosed
WO-2003045315-A2 CARBONYLBENZOXAZINE COMPOUNDS FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES CORTEX PHARMACEUTICALS, INC. (US) 2003-06-05 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 (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-20040259871-A1 Carbonylbenzoxazine compounds for enhancing glutamatergic synaptic responses GAP43, GRIN2B, GRIN2A ALDH1A1 2536/4885CFTR 4698/4885HSD17B10 2389/4885

“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.