SCHEMBL6929324

SCHEMBL6929324

COc1cc(CNCCNCCNCCNCc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
PTGS2 P35354 1/20 0.55
TUBB4A P04350 1/20 0.53
TUBB P07437 1/20 0.53
TUBA3C P0DPH7 1/20 0.53
TUBA1B P68363 1/20 0.53
TUBA4A P68366 1/20 0.53
TUBB4B P68371 1/20 0.53
TUBB3 Q13509 1/20 0.53
TUBB2A Q13885 1/20 0.53
TUBB8 Q3ZCM7 1/20 0.53
TUBA3E Q6PEY2 1/20 0.53
TUBA1A Q71U36 1/20 0.53
TUBA1C Q9BQE3 1/20 0.53
TUBB6 Q9BUF5 1/20 0.53
TUBB2B Q9BVA1 1/20 0.53
TUBB1 Q9H4B7 1/20 0.53
KDM4E B2RXH2 2/20 0.51

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
SCHEMBL8533124 1.00 GAA (0.60) GAAMEN1KMT2APTGS2TUBB4A
SCHEMBL8026574 1.00 GAA (0.60) GAAMEN1KMT2APTGS2TUBB4A
Hydrochloric Acid SCHEMBL8027086 0.98 GAA (0.63) GAAMEN1KMT2APTGS2TUBB4A
Hydrochloric Acid SCHEMBL8409806 0.98 GAA (0.63) GAAMEN1KMT2APTGS2TUBB4A
Hydrochloric Acid SCHEMBL8407992 0.98 GAA (0.63) GAAMEN1KMT2APTGS2TUBB4A
SCHEMBL207179 0.98 GAA (0.62) GAAMEN1KMT2APTGS2TUBB4A
Hydrochloric Acid SCHEMBL8410665 0.96 GAA (0.65) GAAMEN1KMT2APTGS2TUBB4A
SCHEMBL8026568 0.91 GAA (0.55) GAAMEN1KMT2APTGS2TUBB4A
SCHEMBL8531035 0.90 GAA (0.58) GAAMEN1KMT2APTGS2TUBB4A
SCHEMBL9542251 0.90 GAA (0.71) GAAMEN1KMT2APTGS2TUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030224028-A1 Metal complexes for promoting skin desquamation and/or stimulating epidermal renewal SOCIETE L'OREAL S.A. (FR) 2003-12-04 US claimed
EP-1364641-A1 Use of at least one metal complex as a desquamative agent L'OREAL (FR) 2003-11-26 EP claimed
EP-0816324-B1 Subsituted benzyl derivatives of polyalkylene-polyamines and their use in cosmetic and pharmaceutical compositions OREAL (FR) 2000-02-16 EP claimed
EP-0816324-A1 Subsituted benzyl derivatives of polyalkylene-polyamines and their use in cosmetic and pharmaceutical compositions L'OREAL (FR) 1998-01-07 EP claimed
US-20030224028-A1 Metal complexes for promoting skin desquamation and/or stimulating epidermal renewal SOCIETE L'OREAL S.A. (FR) 2003-12-04 US disclosed
EP-1364641-A1 Use of at least one metal complex as a desquamative agent L'OREAL (FR) 2003-11-26 EP disclosed
EP-0816324-B1 Subsituted benzyl derivatives of polyalkylene-polyamines and their use in cosmetic and pharmaceutical compositions OREAL (FR) 2000-02-16 EP disclosed
US-5910513-A PROTECTING THE BODY AGAINST OXIDATIVE STRESS SUCH AS NEURODEGENERATIVE DISEASES, PARKINSON'S DISEASE, CHRONIC INFLAMMATORY CONDITIONS, REINFUSION ISCHAEMIA SYNDROME, THE TOXICITY OF CERTAIN DRUGS SUCH AS CERTAIN XENOBIOTICS L'OREAL (FR) 1999-06-08 US disclosed
EP-0816324-A1 Subsituted benzyl derivatives of polyalkylene-polyamines and their use in cosmetic and pharmaceutical compositions L'OREAL (FR) 1998-01-07 EP 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-20030224028-A1 Metal complexes for promoting skin desquamation and/or stimulating epidermal renewal MC1R, LGMN, CUTA GAA 640/4885MEN1 1745/4885KMT2A 3756/4885

“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.