SCHEMBL1280159

SCHEMBL1280159

CC(C)OC(=O)Nc1nncs1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
FFAR2 O15552 1/20 0.48
CSNK2A2 P19784 1/20 0.48
CSNK2A1 P68400 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CTSK P43235 1/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
POLB P06746 2/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
TAAR1 Q96RJ0 1/20 0.46
PKM P14618 1/20 0.44

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
SCHEMBL1280046 0.82 RAB9A (0.55) LMNAALDH1A1HPGDHSD17B10RAB9A
SCHEMBL1107001 0.77 LMNA (0.62) LMNAFFAR2ALDH1A1HPGDHSD17B10
SCHEMBL1279996 0.77 POLB (0.52) LMNAALDH1A1HPGDHSD17B10RAB9A
SCHEMBL5838495 0.77 CA1 (0.49) LMNAALDH1A1HPGDHSD17B10RAB9A
SCHEMBL564354 0.76
SCHEMBL8752170 0.75 ADRA1A (0.56) LMNAFFAR2ALDH1A1HPGDHSD17B10
SCHEMBL13525912 0.73 L3MBTL1 (0.56) LMNAFFAR2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL20603903 0.72
SCHEMBL13694514 0.72 MAPT (0.55) FFAR2ALDH1A1HPGDHSD17B10RAB9A
SCHEMBL11174268 0.72 FFAR2 (0.57) LMNAFFAR2ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8575144-B2 Beta-lactamase inhibitory compounds SOUTHERN METHODIST UNIVERSITY (US) 2013-11-05 US disclosed
US-20130267537-A1 HETEROCYCLIC SULFONAMIDES CYTOKINETICS, INC. (US) 2013-10-10 US disclosed
US-20130079318-A1 BETA-LACTAMASE INHIBITORY COMPOUNDS SOUTHERN METHODIST UNIVERSITY (US) 2013-03-28 US disclosed
US-8299051-B2 Beta-lactamase inhibitory compounds SOUTHERN METHODIST UNIVERSITY (US) 2012-10-30 US disclosed
US-20120088779-A1 HETEROCYCLIC SULFONAMIDES CYTOKINETICS, INC. 2012-04-12 US disclosed
US-20100009954-A1 BETA-LACTAMASE INHIBITORY COMPOUNDS SOUTHERN METHODIST UNIVERSITY 2010-01-14 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 (4 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-20130267537-A1 HETEROCYCLIC SULFONAMIDES TNNI3, TNNT2, MYLK2 LMNA 1490/4885FFAR2 4342/4885CSNK2A2 458/4885
US-20120088779-A1 HETEROCYCLIC SULFONAMIDES TNNI3, TNNT2, MYLK2 LMNA 1490/4885FFAR2 4342/4885CSNK2A2 458/4885
US-20130079318-A1 BETA-LACTAMASE INHIBITORY COMPOUNDS MGAM, GUSB, LCT LMNA 1042/4885FFAR2 4753/4885CSNK2A2 3217/4885
US-20100009954-A1 BETA-LACTAMASE INHIBITORY COMPOUNDS MGAM, GUSB, LCT LMNA 1042/4885FFAR2 4753/4885CSNK2A2 3217/4885

“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.