SCHEMBL4258705

SCHEMBL4258705

C=C1CCC2CCCC2C1

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
SCHEMBL1634401 0.95 ALDH1A1 (0.42) ALDH1A1
SCHEMBL10844443 0.82 ALDH1A1 (0.40) ALDH1A1
SCHEMBL2206047 0.78 ALDH1A1 (0.47) ALDH1A1
SCHEMBL11788060 0.77 ALDH1A1 (0.44) ALDH1A1
SCHEMBL18597825 0.75 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18799316 0.73
SCHEMBL14401351 0.72
Ethylene SCHEMBL11459229 0.72
SCHEMBL11593525 0.68 ALDH1A1 (0.35) ALDH1A1
SCHEMBL16512839 0.68 ALDH1A1 (0.35) 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
CN-106047499-A Extraction method for Pinus koraiensis volatile oil, forest air and application thereof 吉林森工集团泉阳泉饮品有限公司 2016-10-26 CN disclosed
WO-2009059369-A1 LIQUEFACTION PROCESS ADVANCED BIOFUELS LTD (AU) 2009-05-14 WO disclosed