SCHEMBL14645294

SCHEMBL14645294

O=C(O)Cc1cc(-c2ccccc2C(=O)O)sc1-c1ccc(-c2sc(-c3ccccc3C(=O)O)cc2CC(=O)O)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.41
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX12 P18054 1/20 0.38
ALDH1A1 P00352 6/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 2/20 0.37
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
AKR1B1 P15121 1/20 0.37
GAA P10253 2/20 0.36
BCAT2 O15382 1/20 0.36
MAPK1 P28482 1/20 0.36
MYC P01106 1/20 0.36
LMNA P02545 1/20 0.35
PTPN11 Q06124 1/20 0.35
ALOX15 P16050 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
SCHEMBL14646239 0.95 FOLH1 (0.40) FOLH1CYP3A4CYP2C9ALOX12ALDH1A1
SCHEMBL14646196 0.95 FOLH1 (0.40) FOLH1CYP3A4CYP2C9ALOX12ALDH1A1
SCHEMBL15695253 0.93 MYC (0.40) FOLH1CYP3A4CYP2C9ALOX12ALDH1A1
SCHEMBL14646266 0.89 FOLH1 (0.41) FOLH1CYP3A4CYP2C9ALOX12ALDH1A1
SCHEMBL17803943 0.88 HPGD (0.47) FOLH1ALDH1A1HTTKDM4EUSP2
SCHEMBL15695329 0.88 HPGD (0.39) FOLH1ALDH1A1KDM4EUSP2TSHR
SCHEMBL14645404 0.87 AKR1B1 (0.43) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL14645295 0.86 PTGER1 (0.44) FOLH1ALDH1A1KDM4EUSP2TSHR
SCHEMBL17803971 0.85 HPGD (0.44) FOLH1ALDH1A1HTTKDM4EUSP2
SCHEMBL14646169 0.83 AKR1B1 (0.40) ALDH1A1HTTMEN1KMT2AMAPT

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 8 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
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
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
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 FOLH1 3233/4885CYP3A4 4440/4885CYP2C9 4618/4885

“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.