SCHEMBL17536365

SCHEMBL17536365

CC[CH]C(=O)Nc1ccc(Oc2ccc(C#N)c(OC)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.54
IMPDH2 P12268 5/20 0.49
IMPDH1 P20839 3/20 0.49
ALDH1A1 P00352 1/20 0.46
MTNR1B P49286 5/20 0.45
MTNR1A P48039 3/20 0.45
PLA2G7 Q13093 1/20 0.44
PFKFB2 O60825 4/20 0.43
PFKFB1 P16118 4/20 0.43
PFKFB3 Q16875 4/20 0.43
MET P08581 1/20 0.42
AXL P30530 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
SCHEMBL17536367 0.90 PFKFB1 (0.42) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL17350060 0.87 ALDH1A1 (0.46) ARIMPDH2IMPDH1ALDH1A1MET
SCHEMBL17536366 0.83 MTNR1B (0.63) ARIMPDH2ALDH1A1MTNR1BMTNR1A
SCHEMBL13720420 0.80 AR (0.52) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL12594169 0.80 AR (0.52) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL1979562 0.78 AR (0.55) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL29437996 0.78 AR (0.55) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL21908141 0.77 AR (0.54) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL21980927 0.77 AR (0.48) ARIMPDH2IMPDH1ALDH1A1MTNR1B
SCHEMBL13721221 0.77 AR (0.48) ARIMPDH2IMPDH1ALDH1A1MTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160058737-A1 IMIDAZOLIDINEDIONE DERIVATIVES AUTIFONY THERAPEUTICS LIMITED (GB) 2016-03-03 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-20160058737-A1 IMIDAZOLIDINEDIONE DERIVATIVES KCND3, KCNK3, KCNA3 AR 4780/4885IMPDH2 1230/4885IMPDH1 967/4885

“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.