SCHEMBL17536124

SCHEMBL17536124

CC(C)C1C(=O)NC(=O)NC1=O.[NaH]

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
LMNA P02545 1/20 0.32
PSMD14 O00487 1/20 0.31

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
SCHEMBL642543 0.97 TSHR (0.40) TSHRHSD17B10ALDH1A1KDM4CLMNA
SCHEMBL7080606 0.83 HSD17B10 (0.36) TSHRHSD17B10ALDH1A1KDM4CLMNA
SCHEMBL17070916 0.77 PSMD14 (0.31) PSMD14
SCHEMBL19760869 0.77 PSMD14 (0.30) PSMD14
SCHEMBL22099887 0.77 ALDH1A1 (0.42) ALDH1A1LMNAPSMD14
SCHEMBL17536132 0.77 HSD17B10 (0.38) TSHRHSD17B10ALDH1A1KDM4CLMNA
SCHEMBL17294176 0.73 ALDH1A1 (0.43) TSHRHSD17B10ALDH1A1KDM4CLMNA
SCHEMBL2376039 0.73 HSD17B10 (0.39) TSHRHSD17B10ALDH1A1KDM4CLMNA
SCHEMBL21292107 0.72 ALDH1A1 (0.36) TSHRHSD17B10ALDH1A1KDM4CLMNA
SCHEMBL12481270 0.72 TSHR (0.50) TSHRHSD17B10ALDH1A1KDM4CLMNA

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-9464061-B2 N-hydroxylamino-barbituric acid derivatives THE JOHNS HOPKINS UNIVERSITY (US) 2016-10-11 US disclosed
US-20160060229-A1 N-HYDROXYLAMINO-BARBITURIC ACID DERIVATIVES NATIONAL SCIENCE FOUNDATION 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-20160060229-A1 N-HYDROXYLAMINO-BARBITURIC ACID DERIVATIVES TNNT2, TNNI3, TNNC1 TSHR 2369/4885HSD17B10 607/4885ALDH1A1 654/4885

“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.