SCHEMBL9709436

SCHEMBL9709436

C/C(=C\CCl)CCCC(C)(Cl)CCCC(C)CCCC(C)C

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.54
MEN1 O00255 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 1/20 0.43
PTGS1 P23219 1/20 0.38
PDE4A P27815 1/20 0.38
SNCA P37840 1/20 0.38
PDE3A Q14432 1/20 0.38
LMNA P02545 1/20 0.37
KDM1A O60341 1/20 0.36
PTPN2 P17706 2/20 0.34
CDC25B P30305 2/20 0.34
BLM P54132 1/20 0.33
PSEN1 P49768 2/20 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
SCHEMBL9709440 1.00 PTPN1 (0.54) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL10730519 0.90 PTPN1 (0.41) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL10730516 0.90 PTPN1 (0.41) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL8079393 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL9235719 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL5567283 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL8079265 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL8082399 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL8079263 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A
SCHEMBL31133413 0.86 PTPN1 (0.71) PTPN1MEN1CYP3A4ALOX15KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4665244-A Chlorinated derivatives of hexadecene, their preparation and their use in the synthesis of vitamin E RHONE-POULENC SANTE (FR) 1987-05-12 US claimed
US-5175346-A Catalyst mixture of cuprous chloride and quaternary ammonium salt RHONE-POULENC SANTE (FR) 1992-12-29 US disclosed
US-4665244-A Chlorinated derivatives of hexadecene, their preparation and their use in the synthesis of vitamin E RHONE-POULENC SANTE (FR) 1987-05-12 US disclosed
US-4636570-A Tocopherol derivatives useful in the synthesis of vitamin E and their preparation RHONE-POULENC SANTE (FR) 1987-01-13 US disclosed