SCHEMBL5466784

SCHEMBL5466784

CC(=O)NCCSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.62
LMNA P02545 1/20 0.59
MAPT P10636 1/20 0.59
HPGD P15428 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
PTGES O14684 1/20 0.58
CNR1 P21554 1/20 0.54
EGFR P00533 1/20 0.54

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
SCHEMBL9664403 0.93 KDM4E (0.60) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL5481419 0.88 PTGS1 (0.54) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL5471185 0.86 PTGES (0.64) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL5485404 0.86 MTNR1A (0.56)
SCHEMBL5434845 0.85 MAPK14 (0.49) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL5444999 0.81 PTGES (0.57) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL9215071 0.81 KDM4E (0.68) KDM4ELMNAHPGDPTGES
SCHEMBL13516893 0.80 KDM4E (0.72) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL9665121 0.80 KDM4E (0.77) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL9370520 0.80 KDM4E (0.55) KDM4ELMNAMAPTHPGDSMN1; SMN2

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-20070185169-A1 2-Mercapto-4,5-Diarylimidazole Derivatives and the use thereof as Cyclooxygenase Inhibitors BEIERSDORF, AG 2007-08-09 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-20070185169-A1 2-Mercapto-4,5-Diarylimidazole Derivatives and the use thereof as Cyclooxygenase Inhibitors PTGS2, PTGES2, DHFR KDM4E 520/4885LMNA 4883/4885MAPT 4634/4885

“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.