SCHEMBL8137257

SCHEMBL8137257

OC(Cl)CC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
KDM4E B2RXH2 2/20 0.34
GMNN O75496 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
IDO1 P14902 2/20 0.34
TDO2 P48775 2/20 0.34

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
Cyclohexane SCHEMBL5838004 0.78 TP53 (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL945650 0.78 CHRM5 (0.35)
SCHEMBL20354169 0.78 KDM4E (0.42) TP53KDM4EIDO1
SCHEMBL6548556 0.78 TP53 (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL13169085 0.78 TP53 (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL4756623 0.78 TP53 (0.39) TP53KDM4EGMNNLMNAMAPT
SCHEMBL16933742 0.75
SCHEMBL20038792 0.75
SCHEMBL1037969 0.74 CTSK (0.40)
SCHEMBL21814329 0.74 TP53 (0.36) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000003066-A1 METHOD OF ELECTROCHEMICALLY PRODUCING EPOXIDES PPG INDUSTRIES OHIO, INC. (US) 2000-01-20 WO disclosed