SCHEMBL7571572

SCHEMBL7571572

CC(N)c1c(N)ccc(N)c1C(C)O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2C P18825 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.30
ALOX12 P18054 1/20 0.30
HTT P42858 1/20 0.30
ADRB2 P07550 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
SCHEMBL2037027 0.90 ALDH1A1 (0.34) HIF1AADRA2AADRA2CLMNAKDM4E
SCHEMBL505952 0.79 TDP1 (0.34) ALDH1A1
SCHEMBL4852014 0.75 CYP3A4 (0.43) HIF1AADRA2AADRA2CLMNAKDM4E
SCHEMBL7089983 0.73 PDE2A (0.32)
SCHEMBL3875795 0.73 CYP3A4 (0.33) ALDH1A1
SCHEMBL7577626 0.73
SCHEMBL6865176 0.71 CYP1A2 (0.32) ADRB2
SCHEMBL30937674 0.71 MEN1 (0.33) ALDH1A1
SCHEMBL11415039 0.71 GCGR (0.33) ALDH1A1GAA
SCHEMBL6122863 0.71 CYP3A4 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020189033-A1 Substituted 2-aminoalkyl-1,4diaminobenzene compounds and oxidation dye precursor compositions containing same WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2002-12-19 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-20020189033-A1 Substituted 2-aminoalkyl-1,4diaminobenzene compounds and oxidation dye precursor compositions containing same DDT, CYP1B1, ALDH7A1 HIF1A 1719/4885ADRA2A 2412/4885ADRA2C 1372/4885

“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.