SCHEMBL9611041

SCHEMBL9611041

Cc1ccc(CNC(=O)c2nnc(-c3cc(Cl)c(O)c(Cl)c3)o2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.57
TP53 P04637 2/20 0.50
POLB P06746 1/20 0.50
MAPK14 Q16539 2/20 0.45
KMT2A Q03164 3/20 0.44
HPGD P15428 3/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
MAOB P27338 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
SCHEMBL692348 0.88 MEN1 (0.49) MAPK1MAPK14KMT2AMEN1
SCHEMBL692489 0.84 MAPK14 (0.45) POLBMAPK14KMT2AHPGDALDH1A1
SCHEMBL690195 0.83 AKR1C2 (0.46) MAPK1MAPK14HPGDALDH1A1LMNA
SCHEMBL9613113 0.82 MAPK14 (0.46) MAPK1MAPK14HPGDALDH1A1LMNA
SCHEMBL690828 0.81 SMN1; SMN2 (0.48) TP53POLBKMT2AHPGDMEN1
SCHEMBL692220 0.81 HIF1A (0.47) ALDH1A1
SCHEMBL692237 0.80 PTPN7 (0.42) MAPK1THRBLMNA
SCHEMBL1114466 0.79 ALDH1A1 (0.46) MAPK1TP53POLBKMT2AHPGD
SCHEMBL692923 0.78 FFAR1 (0.45) MAPK14
SCHEMBL690181 0.77 P2RX1 (0.42) TP53POLBTHRBHTTMAOB

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-20120136003-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH 2012-05-31 US disclosed
US-20110288103-A1 COMPOUNDS, COMPOSITIONS, AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH 2011-11-24 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 (2 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-20120136003-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES CFTR, PKD1, PKD2 MAPK1 2718/4885TP53 1900/4885POLB 3401/4885
US-20110288103-A1 COMPOUNDS, COMPOSITIONS, AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES ORAI1, ATP2A3, ANO1 MAPK1 2523/4885TP53 3985/4885POLB 4092/4885

“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.