SCHEMBL8968148

SCHEMBL8968148

C=CCC(=O)O[n+]1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL5874277 0.76 KMT2A (0.30)
SCHEMBL5874405 0.76 TSHR (0.32)
SCHEMBL5875252 0.72 TSHR (0.32)
SCHEMBL1845257 0.72 TSHR (0.33) ALDH1A1
SCHEMBL5875270 0.72 TSHR (0.37)
SCHEMBL4661613 0.72 ELANE (0.35) ALDH1A1
SCHEMBL8723536 0.72
SCHEMBL7212969 0.72 THRB (0.35) ALDH1A1
SCHEMBL5875417 0.71 LMNA (0.35)
Hydrochloric Acid SCHEMBL9656022 0.71 THRB (0.34) 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
EP-0471116-B1 A polymer useful for drag reduction in hydrocarbon fluids and its preparations COUNCIL SCIENT IND RES (IN) 1996-03-06 EP disclosed
EP-0471116-A1 A polymer useful for drag reduction in hydrocarbon fluids and its preparations Council of Scientific & Industrial Research (IN) 1992-02-19 EP disclosed
US-5080121-A Acrylate and ionic monomer COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1992-01-14 US disclosed