SCHEMBL9052371

SCHEMBL9052371

C=CCOC(CO)(CC=C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
TSHR P16473 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
SCHEMBL28430072 0.83 HTT (0.35)
SCHEMBL11498754 0.76
SCHEMBL5371980 0.76 ALDH1A1 (0.34) ALDH1A1TSHR
Diallyl Sulfide SCHEMBL4956576 0.75 ALOX5 (0.33)
SCHEMBL7635975 0.74 TSHR (0.37) ALDH1A1TSHR
SCHEMBL9777705 0.74 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL27595253 0.72 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL15105913 0.71 TSHR (0.35) ALDH1A1TSHR
SCHEMBL27851632 0.71 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL7590961 0.70 HTT (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996041824-A1 GRAFT COPOLYMERS AND THEIR PRODUCTION IMPERIAL EXPLOITATION LIMITED (GB) 1996-12-27 WO disclosed
US-5382633-A Modified polymers 3I RESEARCH EXPLOITATION LIMITED (GB) 1995-01-17 US disclosed
EP-0431015-A1 MODIFIED POLYMERS 3i RESEARCH EXPLOITATION LIMITED (GB) 1991-06-12 EP disclosed
EP-0357267-A1 Modified polymers 3i RESEARCH EXPLOITATION LIMITED (GB) 1990-03-07 EP disclosed
WO-1990001506-A1 MODIFIED POLYMERS 3I RESEARCH EXPLOITATION LIMITED (GB) 1990-02-22 WO disclosed