SCHEMBL7250241

SCHEMBL7250241

CC(C)(O)[C@@H]1CCCC2C1CCC[C@H]2C(C)(C)O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.34
LMNA P02545 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
SCHEMBL7249458 0.88 GBA1 (0.38) GBA1
SCHEMBL7250761 0.88 GBA1 (0.38) GBA1
SCHEMBL7246957 0.85 CYP1A2 (0.33) GBA1
SCHEMBL7246888 0.85 CYP1A2 (0.33) GBA1
SCHEMBL7246270 0.84 SLC18A3 (0.30)
SCHEMBL7256352 0.82
SCHEMBL22520482 0.81 GBA1 (0.37) GBA1LMNA
SCHEMBL5528570 0.78 CA1 (0.36) GBA1LMNA
SCHEMBL18253583 0.78 GBA1 (0.41) GBA1LMNA
SCHEMBL12193703 0.78 NR1H2 (0.33)

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-6576787-B1 Hydroxymethyl-group-containing alicyclic compound and process for producing the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-06-10 US disclosed
EP-1070699-A1 ALICYCLIC COMPOUNDS CONTAINING HYDROXYMETHYL GROUP, PROCESS FOR PRODUCING THE SAME, AND POLYMERIZABLE ALICYCLIC COMPOUND Daicel Chemical Industries, Ltd. (JP) 2001-01-24 EP disclosed