SCHEMBL8079263

SCHEMBL8079263

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

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.71
PTGS1 P23219 1/20 0.47
PDE4A P27815 1/20 0.47
SNCA P37840 1/20 0.47
PDE3A Q14432 1/20 0.47
LMNA P02545 1/20 0.46
KDM1A O60341 1/20 0.46
PTPN2 P17706 1/20 0.41
CDC25B P30305 1/20 0.41
BLM P54132 1/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 1/20 0.40
PSEN1 P49768 2/20 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
SCHEMBL8079392 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL8079393 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL8079265 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL31133413 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL8082396 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL8082399 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL9235719 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL5567283 1.00 PTPN1 (0.71) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL11562598 0.93 PTPN1 (0.63) PTPN1PTGS1PDE4ASNCAPDE3A
SCHEMBL11562595 0.93 PTPN1 (0.63) PTPN1PTGS1PDE4ASNCAPDE3A

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