SCHEMBL19553740

SCHEMBL19553740

C=C1C=CC=C1c1ccccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.43
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA7 P43166 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ PTGS2 P35354 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HPGD P15428 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ METAP2 P50579 1/20 0.37
▸ HTR7 P34969 1/20 0.37
▸ MPO P05164 1/20 0.36
▸ TOP1 P11387 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 1/20 0.36

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
SCHEMBL29429633 0.71 CA1 (0.71) APPCA1CA2CA7CA9
SCHEMBL301996 0.71 CA1 (0.71) APPCA1CA2CA7CA9
SCHEMBL29788337 0.71 CA1 (0.71) APPCA1CA2CA7CA9
SCHEMBL29740506 0.69 CA1 (0.67) APPCA1CA2CA7CA9
SCHEMBL30599266 0.69 CA1 (0.67) APPCA1CA2CA7CA9
SCHEMBL3643541 0.69 CA1 (0.67) APPCA1CA2CA7CA9
SCHEMBL11099503 0.69 CA1 (0.67) APPCA1CA2CA7CA9
SCHEMBL27564617 0.68 DPP4 (0.46) —
SCHEMBL28025956 0.67 PTGS2 (0.49) APPCA1CA2CA7CA9
SCHEMBL8592244 0.65 CA1 (0.60) APPCA1CA2CA7CA9

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-10675300-B2 Group 3 metal compounds and use thereof in the treatment of solid tumors Università degli Studi di Salerno (IT) 2020-06-09 — — US claimed
EP-3452490-B1 GROUP 3 METAL COMPOUNDS AND USE THEREOF IN THE TREATMENT OF SOLID TUMORS UNIV DEGLI STUDI DI SALERNO (IT) 2020-05-13 — — EP claimed
US-20190240254-A1 Group 3 Metal Compounds and Use Thereof in the Treatment of Solid Tumors Università degli Studi di Salerno (IT) 2019-08-08 — — US claimed
EP-3452490-A1 GROUP 3 METAL COMPOUNDS AND USE THEREOF IN THE TREATMENT OF SOLID TUMORS Universitá Degli Studi Di Salerno (IT) 2019-03-13 — — EP claimed
WO-2017191607-A1 GROUP 3 METAL COMPOUNDS AND USE THEREOF IN THE TREATMENT OF SOLID TUMORS Università degli Studi di Salerno (IT) 2017-11-09 — — WO claimed
EP-3452490-A1 GROUP 3 METAL COMPOUNDS AND USE THEREOF IN THE TREATMENT OF SOLID TUMORS Universitá Degli Studi Di Salerno (IT) 2019-03-13 — — EP disclosed
WO-2017191607-A1 GROUP 3 METAL COMPOUNDS AND USE THEREOF IN THE TREATMENT OF SOLID TUMORS Università degli Studi di Salerno (IT) 2017-11-09 — — 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-20190240254-A1 Group 3 Metal Compounds and Use Thereof in the Treatment of Solid Tumors CA4, CA13, CA14 APP 4551/4885CA1 59/4885CA2 46/4885
US-10675300-B2 Group 3 metal compounds and use thereof in the treatment of solid tumors CA4, CA13, CA14 APP 4551/4885CA1 59/4885CA2 46/4885

“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.

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