SCHEMBL758774

SCHEMBL758774

CC(O)C1CCC(C(C)O)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX5 P09917 1/20 0.32
ALDH1A1 P00352 1/20 0.31
SHBG P04278 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
SCHEMBL13855719 0.91 TRPA1 (0.30)
SCHEMBL12058033 0.91 TRPA1 (0.30)
SCHEMBL16105201 0.89 TP53 (0.31) LMNA
SCHEMBL14434079 0.88 TP53 (0.33) LMNACYP2C9SHBG
SCHEMBL4642580 0.88 TP53 (0.33) LMNACYP2C9SHBG
SCHEMBL240851 0.86 ALDH1A1 (0.36) LMNAALOX5ALDH1A1SHBG
SCHEMBL5444346 0.86
SCHEMBL20717783 0.86 LMNA (0.36) LMNACYP2C9ALDH1A1
SCHEMBL6135486 0.86 LMNA (0.36) LMNACYP2C9ALDH1A1
SCHEMBL127724 0.86

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-1567678-B1 PROCESS FOR TANNING AND TANNING AGENT TFL LEDERTECHNIK GMBH (DE) 2012-03-21 EP disclosed
EP-1567678-A1 PROCESS FOR TANNING AND TANNING AGENT TFL Ledertechnik GmbH (DE) 2005-08-31 EP disclosed
WO-2004053170-A1 PROCESS FOR TANNING AND TANNING AGENT TFL LEDERTECHNIK GMBH (DE) 2004-06-24 WO disclosed