SCHEMBL10070263

SCHEMBL10070263

COc1ccccc1CNC[C@H](O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.84

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.58
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
CD274 Q9NZQ7 2/20 0.53
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL10070264 1.00 BCHE (0.58) BCHEMEN1KMT2ACD274KDM4E
SCHEMBL115985 0.91 ABCB1 (0.56) BCHE
SCHEMBL118372 0.86 PRMT5 (0.50) BCHE
SCHEMBL115988 0.86 PRMT5 (0.50) BCHE
SCHEMBL1438054 0.85 BCHE (0.55) BCHE
SCHEMBL324108 0.85 BCHE (0.64) BCHEMEN1KMT2A
SCHEMBL10070262 0.81 MEN1 (0.53) BCHEMEN1KMT2ACD274
SCHEMBL2295540 0.80 APLNR (0.51) BCHEMEN1KMT2ACD274ALDH1A1
SCHEMBL2298148 0.80 APLNR (0.51) BCHEMEN1KMT2ACD274ALDH1A1
SCHEMBL27731741 0.80 APLNR (0.51) BCHEMEN1KMT2ACD274ALDH1A1

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-20120058133-A1 INHIBITION OF TRNA SYNTHETASES AND THERAPEUTIC APPLICATIONS THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-03-08 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-20120058133-A1 INHIBITION OF TRNA SYNTHETASES AND THERAPEUTIC APPLICATIONS THEREOF AARS1, GARS1, TRMT1 BCHE 4506/4885MEN1 4664/4885KMT2A 2778/4885

“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.