SCHEMBL17060544

SCHEMBL17060544

C=CCO[C@@](CO)(CC=C)[C@H]1OC[C@H](O)[C@H]1O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL11444006 0.81 SPHK2 (0.32) ALDH1A1
SCHEMBL8588966 0.65 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2052124 0.65 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2051333 0.65 ALDH1A1 (0.36) ALDH1A1
SCHEMBL12038816 0.64 ALDH1A1 (0.38) ALDH1A1
SCHEMBL13475183 0.64 ALDH1A1 (0.38) ALDH1A1
SCHEMBL2052126 0.64 ALDH1A1 (0.38) ALDH1A1
SCHEMBL12038855 0.64 ALDH1A1 (0.38) ALDH1A1
SCHEMBL14668299 0.64 ALDH1A1 (0.38) ALDH1A1
SCHEMBL2053504 0.64 ALDH1A1 (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9381174-B2 Composition and method for exterminating animal parasite MITSUI CHEMICALS AGRO, INC. (JP) 2016-07-05 US disclosed
US-20150297541-A1 COMPOSITION AND METHOD FOR EXTERMINATING ANIMAL PARASITE MITSUI CHEMICALS AGRO, INC. (JP) 2015-10-22 US disclosed
EP-2915530-A1 COMPOSITION FOR ANIMAL PARASITE EXTERMINATION AND METHOD FOR ANIMAL PARASITE EXTERMINATION Mitsui Chemicals Agro, Inc. (JP) 2015-09-09 EP 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-20150297541-A1 COMPOSITION AND METHOD FOR EXTERMINATING ANIMAL PARASITE HDHD5, H1-3, TUBA3C ALDH1A1 1734/4885

“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.