SCHEMBL3786147

SCHEMBL3786147

C=C(Br)COC(=O)C1CC2OC2C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PPM1B O75688 1/20 0.30
PTPN1 P18031 1/20 0.30
PPP1CC P36873 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
SCHEMBL3785216 0.90 PPM1B (0.33) PPM1BPTPN1PPP1CC
SCHEMBL3785404 0.88 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL3793851 0.84 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2PPM1BPTPN1PPP1CC
SCHEMBL3792975 0.82 PPM1B (0.33) ALDH1A1SMN1; SMN2PPM1BPTPN1PPP1CC
SCHEMBL3788867 0.75 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2PPM1BPTPN1PPP1CC
SCHEMBL3793773 0.74 HPGD (0.33) ALDH1A1SMN1; SMN2
SCHEMBL3789516 0.73 PPM1B (0.36) ALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL14996279 0.73 PPM1B (0.53) ALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL5116555 0.73 PPM1B (0.53) ALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL12632423 0.73 PPM1B (0.53) ALDH1A1PPM1BPTPN1PPP1CC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7696366-B2 Production process of bifunctional epoxy monomer by selective oxidation of diolefin compound SHOWA DENKO K.K. (JP) 2010-04-13 US disclosed
EP-1891031-B1 PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND SHOWA DENKO KK (JP) 2009-03-11 EP disclosed
US-20090030217-A1 PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND SHOWA DENKO K.K. (JP) 2009-01-29 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-20090030217-A1 PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND DUOX2, DUOX1, DDT ALDH1A1 747/4885SMN1; SMN2 2870/4885PPM1B 2020/4885

“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.