SCHEMBL14645236

SCHEMBL14645236

COC(=O)Cc1ccsc1-c1ccc(-c2sc(C(=O)c3cccs3)cc2CC(=O)OC)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.41
NPC1 O15118 5/20 0.41
TP53 P04637 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 6/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 4/20 0.40
GAA P10253 3/20 0.40
CASP1 P29466 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
NFKB1 P19838 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP7 P55210 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 1/20 0.38

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
SCHEMBL14645403 0.94 RAB9A (0.45) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14645324 0.87 NPSR1 (0.38) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14645498 0.86 KMT2A (0.49) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14765277 0.86 HPGD (0.39) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14646181 0.82 KMT2A (0.41) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14646189 0.80 ALDH1A1 (0.55) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14645455 0.79 KMT2A (0.34) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL14645340 0.79 KMT2A (0.36) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL15695284 0.79 MEN1 (0.41) RAB9ANPC1TP53SMN1; SMN2HPGD
SCHEMBL15695224 0.78 KMT2A (0.38) RAB9ANPC1TP53SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9359311-B2 Substituted aromatic oligomers NEUROSCIOS GMBH (AT) 2016-06-07 US disclosed
EP-2817304-A1 NOVEL COMPOUNDS AND THEIR USE IN THERAPY BioChromix NewCo AB (SE) 2014-12-31 EP disclosed
US-20140135322-A1 NOVEL COMPOUNDS AND THEIR USE IN THERAPY BIOCHROMIX PHARMA AB 2014-05-15 US disclosed
WO-2013036196-A1 NOVEL THIOPHENE COMPOUNDS AND METHOD FOR IN VIVO IMAGING BIOCHROMIX AB (SE) 2013-03-14 WO disclosed
WO-2013009259-A1 NOVEL COMPOUNDS AND THEIR USE IN THERAPY BIOCHROMIX PHARMA AB (SE) 2013-01-17 WO 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-20140135322-A1 NOVEL COMPOUNDS AND THEIR USE IN THERAPY PRNP, TBCA, HSPA5 RAB9A 1733/4885NPC1 87/4885TP53 165/4885

“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.