SCHEMBL4523029

SCHEMBL4523029

O=C(C=Cc1ccc(F)cc1)c1sc2ncccc2c1-c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 2/20 0.48
ALOX5 P09917 2/20 0.43
TNFRSF1A P19438 1/20 0.43
DHODH Q02127 1/20 0.42

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
SCHEMBL8237568 0.95 ALOX5 (0.47) PADI4ALOX5
SCHEMBL13605640 0.95 ALOX5 (0.49) PADI4ALOX5
SCHEMBL13605644 0.88 PADI4 (0.44) PADI4
SCHEMBL13605639 0.87 PADI4 (0.49) PADI4
SCHEMBL13605645 0.85 PADI4 (0.54) PADI4
SCHEMBL13605642 0.84 PADI4 (0.48) PADI4
SCHEMBL4533208 0.81 KDM4E (0.49)
Hydrochloric Acid SCHEMBL4520231 0.80 KDM4E (0.48)
SCHEMBL4523027 0.79 TNFRSF1A (0.43) PADI4TNFRSF1A
SCHEMBL8239980 0.77 IKBKB (0.43)

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-20090326001-A1 THIENOPYRIDINE DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS RICHTER GEDEON NYRT. (HU) 2009-12-31 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-20090326001-A1 THIENOPYRIDINE DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRIK5 PADI4 4808/4885ALOX5 521/4885TNFRSF1A 1959/4885

“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.