SCHEMBL15782875

SCHEMBL15782875

CCc1cc2cc(OC)c(OC)cc2c(O)c1C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.44
PDE4A P27815 6/20 0.42
PDE4B Q07343 6/20 0.42
PDE4C Q08493 6/20 0.42
PDE4D Q08499 6/20 0.42
LMNA P02545 1/20 0.41
MAPK1 P28482 2/20 0.41
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.40
CASP3 P42574 2/20 0.40
SENP8 Q96LD8 2/20 0.40
SENP7 Q9BQF6 2/20 0.40
SENP6 Q9GZR1 2/20 0.40
ALDH1A1 P00352 2/20 0.40
APAF1 O14727 1/20 0.40
TDP2 O95551 1/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CDK4 P11802 1/20 0.38

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
SCHEMBL12948355 0.90 HMGCR (0.46) CYP3A4PDE4APDE4BPDE4CPDE4D
SCHEMBL24079189 0.88 PPARA (0.45) CYP3A4PDE4APDE4BPDE4CPDE4D
SCHEMBL15782863 0.75 MAPT (0.45) CYP3A4LMNAGAAMAPT
SCHEMBL15111635 0.75 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL15782860 0.73 CA12 (0.44) HTTALDH1A1HSD17B10KDM4EMAPT
SCHEMBL12303218 0.69 CYP3A4 (0.64) CYP3A4LMNAMAPK1USP2SMN1; SMN2
SCHEMBL15782877 0.69 KDM4E (0.38) HTTKDM4E
SCHEMBL28301388 0.69 DPP4 (0.50) LMNASMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL9752762 0.67 CYP3A4 (0.78) CYP3A4LMNAMAPK1USP2SMN1; SMN2
SCHEMBL27744114 0.67 PDE4A (0.48) CYP3A4PDE4APDE4BPDE4CPDE4D

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-10669244-B2 Synthesis of tetracyclines and analogues thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2020-06-02 US disclosed
EP-3138831-A1 SYNTHESIS OF TETRACYCLINES AND ANALOGUES THEREOF President and Fellows of Harvard College (US) 2017-03-08 EP disclosed
US-20160340325-A1 SYNTHESIS OF TETRACYCLINES AND ANALOGUES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-11-24 US disclosed
US-9365493-B2 Synthesis of tetracyclines and analogues thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-06-14 US disclosed
US-20140163238-A1 SYNTHESIS OF TETRACYCLINES AND ANALOGUES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-06-12 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 (3 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-20140163238-A1 SYNTHESIS OF TETRACYCLINES AND ANALOGUES THEREOF TET1, TET3, MYC CYP3A4 1517/4885PDE4A 4622/4885PDE4B 4589/4885
US-10669244-B2 Synthesis of tetracyclines and analogues thereof TET1, TET3, MYC CYP3A4 1517/4885PDE4A 4622/4885PDE4B 4589/4885
US-20160340325-A1 SYNTHESIS OF TETRACYCLINES AND ANALOGUES THEREOF TET1, TET3, MYC CYP3A4 1517/4885PDE4A 4622/4885PDE4B 4589/4885

“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.