SCHEMBL1935656

SCHEMBL1935656

CCOCCOCC1CO[CH]O1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 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
SCHEMBL1935531 0.90
SCHEMBL2509321 0.87 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL21219016 0.76 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL471904 0.76 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL16005115 0.74 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL9747530 0.74 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL1477234 0.74 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL16004871 0.74 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL16005116 0.74 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL16005031 0.74 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110245249-A1 Heterocyclically Substituted Anilinopyrimidines BAYER CROPSCIENCE AG (DE) 2011-10-06 US claimed
EP-2331533-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES Bayer CropScience AG (DE) 2011-06-15 EP claimed
WO-2010025850-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-03-11 WO claimed
US-20110245249-A1 Heterocyclically Substituted Anilinopyrimidines BAYER CROPSCIENCE AG (DE) 2011-10-06 US disclosed
EP-2331533-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES Bayer CropScience AG (DE) 2011-06-15 EP disclosed
WO-2010025850-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-03-11 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-20110245249-A1 Heterocyclically Substituted Anilinopyrimidines POLL, H1-2, H1-0 SMN1; SMN2 3148/4885ALDH1A1 530/4885TDP1 324/4885

“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.