SCHEMBL20150448

SCHEMBL20150448

OCCSSc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MGLL Q99685 1/20 0.50
ALDH1A1 P00352 5/20 0.44
MAPK1 P28482 2/20 0.44
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 2/20 0.37
FFAR1 O14842 1/20 0.37
RECQL P46063 3/20 0.36
CDC25A P30304 3/20 0.36
CDC25B P30305 3/20 0.36
NPC1 O15118 3/20 0.36
TSHR P16473 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36

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
SCHEMBL12390086 0.85 SMN1; SMN2 (0.44) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL29201828 0.80 HPGD (0.55) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL10700265 0.80 SMN1; SMN2 (0.55) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL12755467 0.79 NR1H2 (0.44) MAPTHPGDHSD17B10ALDH1A1MEN1
SCHEMBL31121202 0.77 MEN1 (0.54) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL1395738 0.77 ALDH1A1 (0.57) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL780107 0.76 MAPT (0.50) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL576091 0.76 MAPT (0.50) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL9655918 0.76 MAPT (0.50) SMN1; SMN2MAPTHPGDHSD17B10MGLL
SCHEMBL28372919 0.76 HPGD (0.50) SMN1; SMN2MAPTHPGDHSD17B10MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180134845-A1 POLYMERIC NANOGELS WITH DEGRADABLE BACKBONES AND FROM GRAS COMPONENTS, AND COMPOSITIONS AND METHODS THEREOF UNIV MASSACHUSETTS (US) 2018-05-17 US disclosed
US-20180134845-A1 POLYMERIC NANOGELS WITH DEGRADABLE BACKBONES AND FROM GRAS COMPONENTS, AND COMPOSITIONS AND METHODS THEREOF UNIV MASSACHUSETTS (US) 2018-05-17 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 (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-20180134845-A1 POLYMERIC NANOGELS WITH DEGRADABLE BACKBONES AND FROM GRAS COMPONENTS, AND COMPOSITIONS AND METHODS THEREOF CD44, PGLS, HPSE SMN1; SMN2 2957/4885MAPT 1122/4885HPGD 938/4885

“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.