SCHEMBL5174346

SCHEMBL5174346

Nc1ccc(CNc2ncccc2Cl)cc1O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
GRM4 Q14833 2/20 0.42
MMP14 P50281 1/20 0.40
KDR P35968 3/20 0.39
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
NPC1 O15118 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
CASP6 P55212 2/20 0.37
AURKA O14965 1/20 0.37
RPS6KB1 P23443 1/20 0.37
EGFR P00533 1/20 0.36

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
SCHEMBL5176296 0.84 KDM4E (0.42) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5175198 0.84 KDM4E (0.51) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5174945 0.83 GAA (0.45) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5174651 0.81 BACE1 (0.44) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5175260 0.81 POLB (0.42) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5175693 0.81 KDM4E (0.52) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5174691 0.80 KDM4E (0.44) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5174762 0.78 MAPT (0.45) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5174298 0.77 POLB (0.49) KDM4ERAB9AMEN1POLBGAA
SCHEMBL5175851 0.76 CXCR4 (0.63) KDM4ERAB9AMEN1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070017040-A1 2-Amino-5-aminomethyl-phenol derivatives and agent for coloring keratin fibers comprising these derivatives PROCTER & GAMBLE COMPANY, THE 2007-01-25 US claimed
EP-1746088-A1 2-Amino-5-aminomethyl-phenol derivatives and agent for coloring keratin fibers comprising these derivatives Wella Aktiengesellschaft (DE) 2007-01-24 EP claimed
US-20070017040-A1 2-Amino-5-aminomethyl-phenol derivatives and agent for coloring keratin fibers comprising these derivatives PROCTER & GAMBLE COMPANY, THE 2007-01-25 US disclosed
EP-1746088-A1 2-Amino-5-aminomethyl-phenol derivatives and agent for coloring keratin fibers comprising these derivatives Wella Aktiengesellschaft (DE) 2007-01-24 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-20070017040-A1 2-Amino-5-aminomethyl-phenol derivatives and agent for coloring keratin fibers comprising these derivatives KRT18, ALDH7A1, MKI67 KDM4E 160/4885RAB9A 3911/4885MEN1 4845/4885

“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.