SCHEMBL13428582

SCHEMBL13428582

O=C(O)/C=C/c1cnc(NCCOc2ccc(F)cc2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MET P08581 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.40
POLB P06746 1/20 0.39
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
TBXAS1 P24557 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 2/20 0.39
ADRA1D P25100 1/20 0.39
HTR2C P28335 1/20 0.39
HTR7 P34969 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39

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
SCHEMBL3225269 0.90 RAB9A (0.49) KMT2AALDH1A1POLBSMN1; SMN2RAB9A
SCHEMBL3225286 0.90 RAB9A (0.49) KMT2AALDH1A1POLBSMN1; SMN2RAB9A
SCHEMBL13429138 0.89 KMT2A (0.48) KMT2AMEN1MAPTHTTNPSR1
SCHEMBL8179174 0.87 KMT2A (0.48) KMT2AMEN1MAPTHTTNPSR1
SCHEMBL13428584 0.87 RAB9A (0.48) KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL13428462 0.84 DRD2 (0.47) ALDH1A1POLBDRD2DRD4DRD3
SCHEMBL13428589 0.82 ALDH1A1 (0.46) KMT2AALDH1A1METSMN1; SMN2RAB9A
SCHEMBL13429097 0.80 HDAC1 (0.59) KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL3215078 0.80 MEN1 (0.52) KMT2AMEN1MAPTHTTNPSR1
SCHEMBL3215094 0.80 MEN1 (0.52) KMT2AMEN1MAPTHTTNPSR1

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-20100069388-A1 N-HYDROXYACRYLAMIDE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2010-03-18 US disclosed
US-20100069388-A1 N-HYDROXYACRYLAMIDE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2010-03-18 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-20100069388-A1 N-HYDROXYACRYLAMIDE COMPOUNDS HDAC1, HDAC11, HDAC2 KMT2A 31/4885MEN1 2025/4885ALDH1A1 1516/4885

“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.