SCHEMBL117389

SCHEMBL117389

Cc1cc(Cl)cc2c(C(=O)OCc3ccc(Cl)c(Cl)c3)cc(-c3ccc(Br)cc3)nc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.48
TP53 P04637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
EPRS1 P07814 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.41

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
SCHEMBL117392 0.81 TP53 (0.49) DHODHTP53RXFP1EPRS1MAPT
SCHEMBL116047 0.78 EPRS1 (0.63) DHODHEPRS1
SCHEMBL117386 0.71 TACR3 (0.62) TP53RXFP1
SCHEMBL117217 0.71 TACR3 (0.62) TP53RXFP1
SCHEMBL118424 0.68 EPRS1 (0.36) DHODHTP53RXFP1EPRS1
SCHEMBL8619775 0.68 PPARA (0.64) DHODHMEN1KMT2AMAPT
SCHEMBL117228 0.67 EPRS1 (0.65) DHODHRXFP1EPRS1MEN1KMT2A
SCHEMBL116062 0.66 EPRS1 (0.64) DHODHEPRS1
SCHEMBL116064 0.66 EPRS1 (0.55) DHODHEPRS1
SCHEMBL14907388 0.65 DHODH (0.46) DHODHMEN1KMT2AMAPT

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-20120058133-A1 INHIBITION OF TRNA SYNTHETASES AND THERAPEUTIC APPLICATIONS THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-03-08 US disclosed
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 DHODH 2635/4885TP53 2745/4885RXFP1 1205/4885

“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.