SCHEMBL13428807

SCHEMBL13428807

CCOC(=O)c1cnc(NCC(=O)NC2CCCCC2)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.48
ALDH1A1 P00352 3/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
LMNA P02545 2/20 0.47
P2RY12 Q9H244 2/20 0.46
MAPK1 P28482 1/20 0.45
MAPT P10636 1/20 0.43
ENPP2 Q13822 1/20 0.42
PKM P14618 1/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 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
SCHEMBL4221919 0.83 P2RY12 (0.51) ALDH1A1KMT2ALMNAP2RY12MAPK1
SCHEMBL13428810 0.82 ALDH1A1 (0.46) L3MBTL1ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL13428482 0.80 LMNA (0.45) ALDH1A1KMT2ASMN1; SMN2TDP1LMNA
SCHEMBL13428467 0.78 POLB (0.44) ALDH1A1KMT2ASMN1; SMN2TDP1LMNA
SCHEMBL13428568 0.74 HPGD (0.40) ALDH1A1KMT2ASMN1; SMN2TDP1LMNA
SCHEMBL1179270 0.74 L3MBTL1 (0.46) L3MBTL1KMT2ASMN1; SMN2P2RY12PKM
SCHEMBL4227879 0.74 P2RY12 (0.47) P2RY12MAPT
SCHEMBL4232969 0.74 P2RY12 (0.47) P2RY12MAPT
SCHEMBL5122057 0.73 ALOX15 (0.64) L3MBTL1ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL13428802 0.73 P2RY12 (0.59) L3MBTL1ALDH1A1LMNAP2RY12MAPT

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 L3MBTL1 1127/4885ALDH1A1 1516/4885KMT2A 31/4885

“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.