SCHEMBL9976552

SCHEMBL9976552

O=C(O)Cc1cc(-c2cccs2)sc1-c1ccc(-c2sc(-c3cccs3)cc2CC(=O)O)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.45
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
KDM4E B2RXH2 8/20 0.43
DPP4 P27487 2/20 0.43
PPARG P37231 1/20 0.43
NCOA2 Q15596 1/20 0.43
NCOA1 Q15788 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
STK17B O94768 1/20 0.42
MAPT P10636 5/20 0.42
GAA P10253 3/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GLA P06280 1/20 0.42
NPC1 O15118 6/20 0.41
RAB9A P51151 5/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41

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
SCHEMBL14646202 0.99 DPP4 (0.45) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL352568 0.94 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL14646178 0.93 ALDH1A1 (0.40) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL15695322 0.91 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL9976555 0.91 DPP4 (0.40) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL14645356 0.91 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL9976554 0.91 DPP4 (0.40) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL13421967 0.89 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL17803966 0.87 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1KDM4EDPP4
SCHEMBL17803941 0.87 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1KDM4EDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2350042-B1 NOVEL THIOPHENE COMPOUNDS FOR USE IN THERAPHY CPL BCX PHARMA AB (SE) 2015-07-29 EP disclosed
US-8710246-B2 Substituted thiophene pentamers BIOCHROMIX NEWCO AB (SE) 2014-04-29 US disclosed
US-8710246-B2 Substituted thiophene pentamers BIOCHROMIX NEWCO AB (SE) 2014-04-29 US disclosed
US-20120157516-A1 NOVEL THIOPHENE COMPOUNDS FOR USE IN THERAPY BIOCHROMIX PHARMA AB 2012-06-21 US disclosed
US-20120157516-A1 NOVEL THIOPHENE COMPOUNDS FOR USE IN THERAPY BIOCHROMIX PHARMA AB 2012-06-21 US disclosed
WO-2010044744-A1 NOVEL THIOPHENE COMPOUNDS FOR IN VIVO IMAGING BIOCHROMIX AB (SE) 2010-04-22 WO disclosed
WO-2010044743-A1 NOVEL THIOPHENE COMPOUNDS FOR USE IN THERAPHY BIOCHROMIX PHARMA AB (SE) 2010-04-22 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-20120157516-A1 NOVEL THIOPHENE COMPOUNDS FOR USE IN THERAPY HSPE1, TTR, HTT ALDH1A1 3577/4885KMT2A 4559/4885MEN1 4815/4885

“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.