SCHEMBL17253264

SCHEMBL17253264

N#Cc1ccc(/N=N/c2ccc(COC(=O)Cl)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
TDP1 Q9NUW8 1/20 0.46
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.45
GAA P10253 2/20 0.44
TSHR P16473 1/20 0.43
RAB9A P51151 3/20 0.43
CYP1B1 Q16678 1/20 0.41
CTBP2 P56545 1/20 0.41
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SMPD1 P17405 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3292009 0.91 ALDH1A1 (0.58) ALDH1A1TDP1GAATSHRRAB9A
SCHEMBL18622524 0.81 PPARD (0.51) ALDH1A1TDP1PPARDPPARAGAA
SCHEMBL3291950 0.81 ALDH1A1 (0.70) ALDH1A1TDP1PPARDPPARARAB9A
SCHEMBL3291946 0.81 ALDH1A1 (0.70) ALDH1A1TDP1PPARDPPARARAB9A
SCHEMBL17694527 0.79 RAB9A (0.44) TDP1PPARDPPARAGAATSHR
SCHEMBL3292480 0.77 ALDH1A1 (0.50) ALDH1A1TDP1PPARDPPARARAB9A
SCHEMBL8021350 0.76 ALDH1A1 (0.78) ALDH1A1TDP1TSHRL3MBTL1
SCHEMBL27263883 0.75 ALDH1A1 (0.60) ALDH1A1TDP1TSHRL3MBTL1
SCHEMBL11844391 0.75 GAA (0.51) TDP1GAATSHRRAB9ACTBP2
SCHEMBL17283451 0.74 ALDH1A1 (0.58) ALDH1A1TDP1GAAL3MBTL1

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-20170073452-A1 POLYGLYOXYLATES, MANUFACTURE AND USE THEREOF THE UNIVERSITY OF WESTERN ONTARIO (CA) 2017-03-16 US disclosed
WO-2015168809-A1 POLYGLYOXYLATES, MANUFACTURE AND USE THEREOF THE UNIVERSITY OF WESTERN ONTARIO (CA) 2015-11-12 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-20170073452-A1 POLYGLYOXYLATES, MANUFACTURE AND USE THEREOF IDUA, IDE, PUF60 ALDH1A1 4449/4885TDP1 606/4885PPARD 4784/4885

“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.