SCHEMBL14645336

SCHEMBL14645336

COC(=O)Cc1cc(C(=O)c2ccccc2)sc1-c1ccc(-c2sc(C(=O)c3ccccc3)cc2CC(=O)OC)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.43
CLK1 P49759 1/20 0.40
DYRK1A Q13627 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
HPGD P15428 4/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.40
ACACA Q13085 1/20 0.39
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37

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
SCHEMBL14645324 0.92 NPSR1 (0.38) NPSR1CLK1DYRK1ADYRK1BHPGD
SCHEMBL16893413 0.88 MAPT (0.46) NPSR1CLK1DYRK1ADYRK1BHPGD
SCHEMBL14645387 0.85 KMT2A (0.51) CLK1DYRK1ADYRK1BHPGDALDH1A1
SCHEMBL14645403 0.82 RAB9A (0.45) HPGDALDH1A1MAPTKMT2AKDM4E
SCHEMBL16904662 0.81 MAPT (0.56) NPSR1HPGDALDH1A1MAPTKMT2A
SCHEMBL3053459 0.81 MEN1 (0.50) NPSR1HPGDALDH1A1MAPTKMT2A
SCHEMBL16893534 0.81 MEN1 (0.53) HPGDALDH1A1MAPTKMT2AKDM4E
SCHEMBL16893438 0.79 MAPK13 (0.49) HPGDMAPTKMT2ALMNATDP1
SCHEMBL16893377 0.79 MEN1 (0.48) NPSR1HPGDALDH1A1MAPTKMT2A
SCHEMBL14645236 0.78 RAB9A (0.41) NPSR1HPGDALDH1A1MAPTKMT2A

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 NPSR1 2158/4885CLK1 3906/4885DYRK1A 4731/4885

“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.