SCHEMBL14019677

SCHEMBL14019677

C=C(C(=O)OC)C12CCC1C2

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL1395183 0.89 ALDH1A1 (0.33) ALDH1A1
SCHEMBL13688358 0.88 CYP3A4 (0.35) ALDH1A1
SCHEMBL13008563 0.73 ALDH1A1 (0.35) ALDH1A1
SCHEMBL13001800 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL13688355 0.71 CYP3A4 (0.37) ALDH1A1
SCHEMBL7183192 0.70 ALDH1A1 (0.35) ALDH1A1
SCHEMBL4002175 0.70 CYP3A4 (0.32)
SCHEMBL13108998 0.70
SCHEMBL13008170 0.70
SCHEMBL14019694 0.70 CYP3A4 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080261118-A1 OPTICAL RECORDING COMPOSITION AND HOLOGRAPHIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-10-23 US disclosed
US-20080261118-A1 OPTICAL RECORDING COMPOSITION AND HOLOGRAPHIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-10-23 US disclosed
US-7365222-B2 1,1-Disubstituted 2-vinylcyclopropanes; free radical polymerizable monomers IVOCLAR VIVADENT AG (LI) 2008-04-29 US disclosed
US-7365222-B2 1,1-Disubstituted 2-vinylcyclopropanes; free radical polymerizable monomers IVOCLAR VIVADENT AG (LI) 2008-04-29 US disclosed