SCHEMBL7784033

SCHEMBL7784033

C=C(C)C(=O)OCC1CC2CC1C1CC(CO)CC21

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TSHR P16473 3/20 0.33
THRB P10828 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
SCHEMBL11921512 0.92 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
SCHEMBL21093696 0.86 ALDH1A1 (0.40) ALDH1A1TSHR
SCHEMBL18900335 0.86 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
SCHEMBL12737059 0.85 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL24991944 0.84 ALDH1A1 (0.38) ALDH1A1
SCHEMBL12952321 0.84 ALDH1A1 (0.38) ALDH1A1TSHRTHRB
SCHEMBL12952323 0.84 ALDH1A1 (0.38) ALDH1A1TSHRTHRB
SCHEMBL13224470 0.84 ALDH1A1 (0.38) ALDH1A1
SCHEMBL12951948 0.84 ALDH1A1 (0.38) ALDH1A1
SCHEMBL12926948 0.84 ALDH1A1 (0.38) ALDH1A1TSHRTHRB

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-0875496-B1 Acrylic or methacrylic acid derivatives and polymers obtained therefrom WAKO PURE CHEM IND LTD (JP) 2001-11-07 EP disclosed
EP-0875789-A1 Resist composition and its use for forming pattern WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1998-11-04 EP disclosed
EP-0875496-A1 Acrylic or methacrylic acid derivatives and polymers obtained therefrom WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1998-11-04 EP disclosed