SCHEMBL6663981

SCHEMBL6663981

CC(O)C1CCCCCCCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
KDM4E B2RXH2 2/20 0.44
GMNN O75496 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SHBG P04278 1/20 0.43
EPHX1 P07099 3/20 0.40
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
MMP2 P08253 2/20 0.39
CA9 Q16790 2/20 0.39

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
SCHEMBL18707170 1.00 TP53 (0.46) TP53KDM4EGMNNLMNAMAPT
SCHEMBL1056494 1.00
SCHEMBL1053407 1.00
SCHEMBL5195 1.00
SCHEMBL8086336 1.00 TP53 (0.46) TP53KDM4EGMNNLMNAMAPT
SCHEMBL18706728 1.00 TP53 (0.46) TP53KDM4EGMNNLMNAMAPT
SCHEMBL11165174 1.00 TP53 (0.46) TP53KDM4EGMNNLMNAMAPT
SCHEMBL4731258 1.00 TP53 (0.46) TP53KDM4EGMNNLMNAMAPT
SCHEMBL8008434 0.97 TP53 (0.44) TP53KDM4EGMNNLMNAMAPT
Ammonia Solution, Strong SCHEMBL11270348 0.97 TP53 (0.44) TP53KDM4EGMNNLMNAMAPT

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-2004002930-A1 ODORIFEROUS SUBSTANCES AND METHOD FOR THE PRODUCTION THEREOF SYMRISE GMBH & CO. KG (DE) 2004-01-08 WO disclosed
US-4393245-A 1-ACETYL-1-CYCLODODECENE BASF AKTIENGESELLSCHAFT (DE) 1983-07-12 US disclosed