SCHEMBL20374476

SCHEMBL20374476

COC(=O)c1ccc(C2=CC(=O)CCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 1/20 0.50
SLC6A3 Q01959 1/20 0.48
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
CA7 P43166 1/20 0.47
PTPRC P08575 1/20 0.46
PTPRF P10586 1/20 0.46
PTPN1 P18031 1/20 0.46
CDC25B P30305 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.44
POLB P06746 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL20370324 0.81 ALDH1A1 (0.47) CA1CA12CA9TDP1TSHR
SCHEMBL20358397 0.78 POLB (0.63) SETD7TDP1KMT2APOLBHSD17B10
SCHEMBL26090324 0.78 CA1 (0.48) SETD7SLC6A3CA1CA2CA12
SCHEMBL2944680 0.77 ALDH1A1 (0.48) SLC6A3CA1CA2CA12CA9
SCHEMBL20370328 0.77 SMN1; SMN2 (0.36) SLC6A3PTPN1ALDH1A1MAPT
SCHEMBL2950950 0.75 ALDH1A1 (0.47) SLC6A3CA1CA2CA12CA9
SCHEMBL2949298 0.75 ALDH1A1 (0.47) SLC6A3CA1CA2CA12CA9
SCHEMBL2949295 0.75 ALDH1A1 (0.47) SLC6A3CA1CA2CA12CA9
SCHEMBL19387238 0.75 CA1 (0.70) SETD7CA1CA2CA12CA9
Cyclohexane SCHEMBL1133519 0.75 CA1 (0.70) CA1CA2CA12CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11345652-B2 Anticonvulsant compounds OWEN-BARRY PHARMACEUTICALS (CA) 2022-05-31 US disclosed
US-20200148623-A1 ANTICONVULSANT COMPOUNDS OWEN-BARRY PHARMACEUTICALS INC. (CA) 2020-05-14 US disclosed
US-10556853-B2 Anticonvulsant compounds OWEN-BARRY PHARMACEUTICALS INC. (CA) 2020-02-11 US disclosed
WO-2018129609-A1 ANTICONVULSANT COMPOUNDS OWEN-BARRY PHARMACEUTICALS INC. (CA) 2018-07-19 WO disclosed
US-20180194715-A1 ANTICONVULSANT COMPOUNDS OWEN-BARRY PHARMACEUTICALS INC. (CA) 2018-07-12 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 (4 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-20180194715-A1 ANTICONVULSANT COMPOUNDS GABRE, CACNA1B, GRIK5 SETD7 4560/4885SLC6A3 1031/4885CA1 102/4885
US-20200148623-A1 ANTICONVULSANT COMPOUNDS GABRE, CACNA1B, GRIK5 SETD7 4560/4885SLC6A3 1031/4885CA1 102/4885
US-11345652-B2 Anticonvulsant compounds GABRE, CACNA1B, GRIK5 SETD7 4560/4885SLC6A3 1031/4885CA1 102/4885
US-10556853-B2 Anticonvulsant compounds GABRE, CACNA1B, GRIK5 SETD7 4560/4885SLC6A3 1031/4885CA1 102/4885

“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.