SCHEMBL14733495

SCHEMBL14733495

CC[C@H](CCC(=O)OC)NC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
ANPEP P15144 1/20 0.42
ENPEP Q07075 1/20 0.42
SLC1A1 P43005 1/20 0.41
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
CA12 O43570 4/20 0.36
LMNA P02545 3/20 0.36
CA14 Q9ULX7 3/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL14733432 0.88 TSHR (0.52) TSHRANPEPENPEPSLC1A1KMT2A
SCHEMBL18264860 0.84 L3MBTL1 (0.50) TSHRANPEPENPEPKMT2AL3MBTL1
SCHEMBL16301550 0.83 TSHR (0.48) TSHRSLC1A1KMT2AMEN1L3MBTL1
SCHEMBL8861959 0.83 TSHR (0.48) TSHRANPEPENPEPSLC1A1KMT2A
SCHEMBL2758953 0.83 TSHR (0.48) TSHRANPEPENPEPSLC1A1KMT2A
SCHEMBL9607938 0.79 TSHR (0.43) TSHRANPEPENPEPSLC1A1KMT2A
SCHEMBL9856671 0.78 TSHR (0.40) TSHRANPEPENPEPKMT2AMEN1
SCHEMBL12295404 0.78 TSHR (0.40) TSHRANPEPENPEPKMT2AMEN1
Hydrochloric Acid SCHEMBL4169104 0.77 ANPEP (0.64) ANPEPENPEPSLC1A1
SCHEMBL9606840 0.76 TSHR (0.55) TSHRSLC1A1KMT2AMEN1L3MBTL1

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-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2013-02-28 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-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 TSHR 3960/4885ANPEP 2983/4885ENPEP 2625/4885

“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.