SCHEMBL8506502

SCHEMBL8506502

C=COC(CC1CO1)C(C)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL27039583 0.71 ALDH1A1 (0.48) ALDH1A1
SCHEMBL28343789 0.69 ALDH1A1 (0.42) ALDH1A1
SCHEMBL6255478 0.69
SCHEMBL29421081 0.68 ALDH1A1 (0.33) ALDH1A1
SCHEMBL4291612 0.68
SCHEMBL15893000 0.67 ALDH1A1 (0.33) ALDH1A1
SCHEMBL193534 0.67
SCHEMBL8442819 0.67
SCHEMBL10070931 0.67
SCHEMBL9090571 0.67 MEN1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999064484-A1 POLYMERIZATION OF VINYL ETHERS MOLTECH CORPORATION (US) 1999-12-16 WO claimed
WO-1999064484-A1 POLYMERIZATION OF VINYL ETHERS MOLTECH CORPORATION (US) 1999-12-16 WO disclosed