SCHEMBL6749784

SCHEMBL6749784

C=C(CO)C(=O)OC1C2CC3CC(C2)CC1(CC)C3

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL5917750 0.86 EPHX2 (0.32) EPHX2ALDH1A1
SCHEMBL453582 0.86 EPHX2 (0.31) EPHX2ALDH1A1
SCHEMBL6749745 0.83
SCHEMBL6859010 0.79 ALDH1A1 (0.31) ALDH1A1
SCHEMBL451377 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL26078962 0.77 SCN1A (0.40) ALDH1A1
SCHEMBL12346676 0.76 ALDH1A1 (0.33) EPHX2ALDH1A1
SCHEMBL548176 0.75 ALDH1A1 (0.32) EPHX2ALDH1A1
SCHEMBL3053351 0.75 MEN1 (0.33) EPHX2ALDH1A1
SCHEMBL13447548 0.73 ALDH1A1 (0.31) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040019152-A1 Alcoholic hydroxyl group-, aromatic ring- and protolytically leaving group-containing copolymer NIPPON SHOKUBAI CO., LTD. 2004-01-29 US disclosed
EP-1357428-A1 Alcoholic hydroxyl group-, aromatic ring- and protolytically leaving group-containing copolymer Nippon Shokubai Co., Ltd. (JP) 2003-10-29 EP disclosed