SCHEMBL8079352

SCHEMBL8079352

C/C(=C\CO)CCCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 1.00
LMNA P02545 1/20 0.48
PTGS1 P23219 1/20 0.48
PDE4A P27815 1/20 0.48
SNCA P37840 1/20 0.48
PDE3A Q14432 1/20 0.48
KDM1A O60341 1/20 0.47
PTPN2 P17706 1/20 0.42
CDC25B P30305 1/20 0.42
BLM P54132 1/20 0.41
MEN1 O00255 3/20 0.41
CYP3A4 P08684 3/20 0.41
ALOX15 P16050 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
UGT1A1 P22309 1/20 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
Trans-Phytol SCHEMBL16367022 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
SCHEMBL8070052 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
SCHEMBL4718132 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
Trans-Phytol SCHEMBL22784 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
SCHEMBL8079351 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
SCHEMBL8079353 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
Trans-Phytol SCHEMBL16367020 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
Trans-Phytol SCHEMBL14763835 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
Trans-Phytol SCHEMBL17962948 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA
Trans-Phytol SCHEMBL3133654 1.00 PTPN1 (1.00) PTPN1LMNAPTGS1PDE4ASNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0677520-B1 Process for the preparation of alpha-tocopherol derivatives, and catalyst EISAI CO LTD (JP) 2000-08-30 EP disclosed
EP-0658552-B1 Process for the preparation of alpha-tocopherol derivatives EISAI CO LTD (JP) 1999-03-31 EP disclosed
US-5610113-A REACTION OF TRIMETHYLHYDROQUINONE AND ISOPHYTOL, CONDENSATION AND CYCLIZATION, SCANDIUM SAPONITE CATALYST EISAI CO., LTD. (JP) 1997-03-11 US disclosed
US-5536852-A ETHERIFICATION, CYCLIZATION EISAI CO., LTD. (JP) 1996-07-16 US disclosed
US-5532387-A CYCLIZATION OF TRIMETHYLHYDROQUINONE AND AN ALKENYL ALCOHOL, REUSABLE CATALYST, IIIB FLUOROSULFONATE, NITRATE, SULFATE, OR FLUOROALKYLSULFONATE EISAI CO., LTD. (JP) 1996-07-02 US disclosed
EP-0677520-A1 Process for the preparation of alpha-tocopherol derivatives, and catalyst Eisai Co., Ltd. (JP) 1995-10-18 EP disclosed
EP-0658552-A1 Process for the preparation of alpha-tocopherol derivatives Eisai Co., Ltd. (JP) 1995-06-21 EP disclosed