SCHEMBL6388705

SCHEMBL6388705

Cc1cc(N2CC(NCCO)CC2CO)ccc1N

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL6388818 0.92 RAD52 (0.35) RAD52GAATHRBKDM4EMAPT
SCHEMBL6384690 0.87 RAD52 (0.36) RAD52GAATHRBKDM4EMAPT
SCHEMBL6386455 0.83 POLB (0.37) RAD52GAATHRB
SCHEMBL6390344 0.83 THRB (0.36) RAD52GAATHRB
SCHEMBL6387832 0.82 GBA1 (0.33)
SCHEMBL6387450 0.76 RAD52 (0.39) RAD52GAATHRBKDM4EMAPT
Hydrochloric Acid SCHEMBL6095935 0.76 RAD52 (0.40) RAD52GAATHRBKDM4EMAPT
SCHEMBL6385931 0.75 RAD52 (0.35) RAD52GAATHRBKDM4EMAPT
SCHEMBL6385952 0.75 RAD52 (0.35) RAD52GAATHRBKDM4EMAPT
SCHEMBL6386855 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050097682-A9 Oxidation dyeing composition based on 1-(4-aminophenyl)pyrrolidines substituted in positions 2 and 4 L'OREAL S.A. (FR) 2005-05-12 US claimed
US-20050097682-A9 Oxidation dyeing composition based on 1-(4-aminophenyl)pyrrolidines substituted in positions 2 and 4 L'OREAL S.A. (FR) 2005-05-12 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 (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-20050097682-A9 Oxidation dyeing composition based on 1-(4-aminophenyl)pyrrolidines substituted in positions 2 and 4 PYCR1, KRT18, COX5A RAD52 563/4885GAA 4471/4885THRB 4663/4885

“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.