SCHEMBL9766174

SCHEMBL9766174

OCCCCCCC(O)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
KDM4E B2RXH2 1/20 0.47
GMNN O75496 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
EPHX1 P07099 1/20 0.40
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL11591769 1.00 TP53 (0.48) TP53KDM4EGMNNLMNAMAPT
SCHEMBL10358405 0.98 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL9122339 0.96 TP53 (0.46) TP53KDM4EGMNNLMNAMAPT
SCHEMBL2035572 0.91 TP53 (0.52) TP53KDM4EGMNNLMNAMAPT
SCHEMBL4298582 0.82 TP53 (0.56) TP53KDM4EGMNNLMNAMAPT
SCHEMBL11607011 0.82 TP53 (0.47) TP53KDM4EGMNNLMNAMAPT
SCHEMBL8413380 0.82 TP53 (0.47) TP53KDM4EGMNNLMNAMAPT
SCHEMBL2858662 0.82 TP53 (0.47) TP53KDM4EGMNNLMNAMAPT
SCHEMBL31562869 0.82 TP53 (0.47) TP53KDM4EGMNNLMNAMAPT
SCHEMBL9958443 0.81 EPHX1 (0.43) 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-1991010679-A2 RENIN INHIBITING PEPTIDES HAVING AN 'alpha'-HETEROATOM AMINO ACID AT THE P3 POSITION WARNER LAMBERT CO (US) 1991-07-25 WO disclosed