SCHEMBL5316009

SCHEMBL5316009

COc1ccc(OC)c(Nc2nc(-c3ccccc3)nc3ccsc23)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.62
KMT2A Q03164 9/20 0.58
MEN1 O00255 8/20 0.58
LMNA P02545 5/20 0.58
L3MBTL1 Q9Y468 4/20 0.58
KDM4E B2RXH2 4/20 0.58
TDP1 Q9NUW8 2/20 0.58
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
CSNK2A1 P68400 2/20 0.54
RXFP1 Q9HBX9 1/20 0.53
ABCG2 Q9UNQ0 4/20 0.52
ALDH1A1 P00352 2/20 0.52
TP53 P04637 3/20 0.52
MAPK1 P28482 2/20 0.50
HPGD P15428 2/20 0.49
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49

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
SCHEMBL5315120 0.83 CSNK2A1 (0.53) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL5317122 0.80 HTT (0.54) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL5317160 0.78 MEN1 (0.55) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL5337350 0.75 EGFR (0.52) MAPTKMT2AMEN1KDM4ECSNK2A1
Hydrochloric Acid SCHEMBL5579997 0.75 PDE4A (0.76) KMT2AMEN1LMNACYP3A4CYP2C9
SCHEMBL5331294 0.74 KMT2A (0.55) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL14474543 0.73 ABCG2 (0.65) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL7699357 0.72 KMT2A (0.62) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL5315835 0.72 ABCG2 (0.49) MAPTKMT2AMEN1CYP3A4ABCG2
SCHEMBL9881233 0.72 CYP1A2 (0.61) MAPTKMT2AMEN1LMNAL3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070099877-A1 N-aryl-thienopyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2007-05-03 US claimed
WO-2007056215-A9 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA INC (US) 2007-09-13 WO disclosed
WO-2007056215-A2 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA, INC. (US) 2007-05-18 WO disclosed
US-20070099877-A1 N-aryl-thienopyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2007-05-03 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-20070099877-A1 N-aryl-thienopyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP4, CASP3, API5 MAPT 4267/4885KMT2A 3038/4885MEN1 1984/4885

“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.