SCHEMBL2706443

SCHEMBL2706443

O=c1ccc2c(o1)CCC=C2

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.32
CA9 Q16790 2/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
MCL1 Q07820 1/20 0.32
SOST Q9BQB4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAOA P21397 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
SCHEMBL1317863 0.69 GSK3A (0.40) CA9CA12LMNAMCL1TDP1
SCHEMBL28402894 0.68 HPGD (0.37) LMNAALDH1A1
SCHEMBL8487842 0.68 CA1 (0.32) CA1CA9CA12CA2LMNA
SCHEMBL13474023 0.65 TDP1 (0.31) TDP1
SCHEMBL8666055 0.63 ALDH1A1 (0.31) ALDH1A1
SCHEMBL14207200 0.63
SCHEMBL2525091 0.61 FFAR4 (0.31)
SCHEMBL6938317 0.60 ALDH1A1 (0.31) CA1CA9ALDH1A1
SCHEMBL6822041 0.60 ALDH1A1 (0.40) CA1CA9CA12CA2LMNA
SCHEMBL18602818 0.59 CA1 (0.34) CA1CA9LMNAALDH1A1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111888353-A Application of daphnetin in preparation of medicine for preventing and/or treating muscular atrophy, sarcopenia and hypokinesia caused by aging 西安交通大学 2020-11-06 CN disclosed
EP-3415494-B1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2019-10-30 EP disclosed
EP-3205640-B1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2019-05-22 EP disclosed
EP-3035121-B1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2019-03-13 EP disclosed
EP-3168207-B1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2019-02-06 EP disclosed
EP-3205640-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS Shin-Etsu Chemical Co., Ltd. (JP) 2017-08-16 EP disclosed
EP-3168207-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS Shin-Etsu Chemical Co., Ltd. (JP) 2017-05-17 EP disclosed
EP-2993520-B1 RESIST COMPOSITION AND PATTERNING PROCESS SHINETSU CHEMICAL CO (JP) 2017-03-08 EP disclosed
EP-2450038-A1 A PHARMACEUTICAL COMPOSITION FOR TREATING DIABETIC NEPHROPATHY AND THE PREPARATION METHOD AND USE THEREOF Guangzhou Consun Medicine R&D Co., Ltd. (CN) 2012-05-09 EP disclosed
US-20100267819-A1 PHARMACEUTICAL COMPOSITION FOR DIABETIC NEPHROPATHY AND ITS PREPARATION AND APPLICATION Guangzhou Consun Medicine R&D Medicine (CN) 2010-10-21 US disclosed
CN-1594304-A Process for preparation of 7,8-dihydrocoumarin included by cyclodextrin and its derivatives JILIN XIDIAN PHARMACEUTICAL TE (CN) 2005-03-16 CN disclosed
CN-1594304-A Process for preparation of 7,8-dihydrocoumarin included by cyclodextrin and its derivatives JILIN XIDIAN PHARMACEUTICAL TE (CN) 2005-03-16 CN 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-20100267819-A1 PHARMACEUTICAL COMPOSITION FOR DIABETIC NEPHROPATHY AND ITS PREPARATION AND APPLICATION REN, ATP6V1B1, CYP2A7 CA1 4591/4885CA9 1737/4885CA12 4003/4885

“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.