SCHEMBL11628675

SCHEMBL11628675

CC(=O)C1NC(=O)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
RGS12 O14924 1/20 0.41
HSD17B10 Q99714 1/20 0.36
RBP4 P02753 1/20 0.35
LMNA P02545 1/20 0.34
USP2 O75604 1/20 0.33
BACE1 P56817 1/20 0.32
GAA P10253 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MAPK1 P28482 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL3501182 0.80 TSHR (0.44) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL2064738 0.78 TSHR (0.42) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL2184430 0.76 TSHR (0.50) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL5916254 0.74 TSHR (0.39) TSHRRGS12HSD17B10RBP4BACE1
Potassium Ion SCHEMBL16597641 0.74 TSHR (0.44) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL16597486 0.74 TSHR (0.44) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL16597743 0.74 TSHR (0.44) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL17570777 0.74 TSHR (0.40) TSHRRGS12TDP1MAPK1
SCHEMBL11308612 0.73 TSHR (0.38) TSHRRGS12HSD17B10RBP4LMNA
SCHEMBL8663025 0.71 HSD17B10 (0.42) TSHRRGS12HSD17B10LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960353-B2 Novobiocin analogues as neuroprotective agents and in the treatment of autoimmune disorders UNIVERSITY OF KANSAS (US) 2011-06-14 US disclosed
US-20100105630-A1 NOVOBIOCIN ANALOGUES AS NEUROPROTECTIVE AGENTS AND IN THE TREATMENT OF AUTOIMMUNE DISORDERS UNIVERSITY OF KANSAS (US) 2010-04-29 US disclosed
US-4113950-A PROCESS FOR PREPARING OROTIC ACID AND THIOOROTIC ACID DIAMALT AKTIENGESELLSCHAFT (DE) 1978-09-12 US disclosed
US-4062847-A Process for preparing orotic acid DIAMALT AKTIENGESELLSCHAFT (DT) 1977-12-13 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-20100105630-A1 NOVOBIOCIN ANALOGUES AS NEUROPROTECTIVE AGENTS AND IN THE TREATMENT OF AUTOIMMUNE DISORDERS SSB, IAPP, NLN TSHR 3684/4885RGS12 3653/4885HSD17B10 1633/4885

“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.