SCHEMBL13428462

SCHEMBL13428462

O=Cc1cnc(NCCOc2ccc(F)cc2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.47
DRD4 P21917 2/20 0.47
DRD3 P35462 2/20 0.47
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTR7 P34969 7/20 0.40
ADRA1D P25100 4/20 0.40
ADRA1A P35348 4/20 0.40
ADRA1B P35368 4/20 0.40
HTR2C P28335 3/20 0.40
POLB P06746 1/20 0.38
CHRNA7 P36544 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HTR1A P08908 1/20 0.37
GRIN1 Q05586 1/20 0.37
KCNH2 Q12809 1/20 0.37
GRIN2B Q13224 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
PIK3CD O00329 1/20 0.36

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
SCHEMBL3222922 0.87 PIK3CD (0.48) DRD2DRD4DRD3ALDH1A1HTR7
SCHEMBL13428582 0.84 KMT2A (0.48) DRD2DRD4DRD3ALDH1A1HTR7
SCHEMBL13428460 0.84 DRD4 (0.46) DRD2DRD4DRD3ALDH1A1L3MBTL1
SCHEMBL13429138 0.82 KMT2A (0.48) RAB9ASMN1; SMN2
SCHEMBL13428454 0.80 DRD2 (0.44) DRD2DRD4DRD3HTR7ADRA1D
SCHEMBL13428483 0.79 CCNB2 (0.41) ALDH1A1L3MBTL1POLBNPC1RAB9A
SCHEMBL3217492 0.78 P2RY12 (0.48) L3MBTL1CHRNA7NPC1MAOB
SCHEMBL3225261 0.76 ALDH1A1 (0.54) DRD2DRD4DRD3ALDH1A1L3MBTL1
SCHEMBL13428501 0.76 POLB (0.37) ALDH1A1L3MBTL1POLBNPC1RAB9A
SCHEMBL13428507 0.73 MAPT (0.41) ALDH1A1L3MBTL1POLBNPC1RAB9A

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 DRD2 1518/4885DRD4 3477/4885DRD3 1647/4885

“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.