SCHEMBL10170655

SCHEMBL10170655

C=C(C)c1ccc(C#N)c(OC)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.49
ALDH1A1 P00352 6/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 1/20 0.40
MAPK8 P45983 2/20 0.37
MAPK9 P45984 2/20 0.37
MAPK10 P53779 2/20 0.37
POLB P06746 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
IMPDH2 P12268 1/20 0.34
IMPDH1 P20839 1/20 0.34
USP2 O75604 1/20 0.34
HPGD P15428 3/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
KDM5A P29375 1/20 0.33
SQOR Q9Y6N5 1/20 0.33

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
SCHEMBL4196059 0.80 KDM4E (0.49) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL10567317 0.79 GAA (0.56) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL10170664 0.77 AR (0.39) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL10170657 0.77 ALDH1A1 (0.40) ALDH1A1L3MBTL1SMN1; SMN2KDM5A
SCHEMBL3967032 0.75 KDM4E (0.54) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL19407611 0.75 KDM4E (0.41) KDM4EALDH1A1KMT2AL3MBTL1POLB
SCHEMBL1937421 0.75 KDM4E (0.54) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL18552959 0.75 KDM4E (0.33) KDM4EL3MBTL1POLBMAPT
SCHEMBL19407676 0.74 GRM4 (0.42) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL3967035 0.73 KDM4E (0.56) KDM4EALDH1A1MEN1KMT2AL3MBTL1

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-8168668-B2 Compounds ASTRAZENECA AB (SE) 2012-05-01 US disclosed
US-20100286202-A1 New Compounds ASTRAZENECA AB (SE) 2010-11-11 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-20100286202-A1 New Compounds REN, PCSK9, FURIN KDM4E 3569/4885ALDH1A1 1484/4885MEN1 660/4885

“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.