SCHEMBL3919693

SCHEMBL3919693

O=S(=O)(O)c1ccccc1F.[Sc]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT6A Q92794 2/20 0.44
▸ MYC P01106 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD11B1 P28845 1/20 0.42
▸ GBA1 P04062 1/20 0.42
▸ TTR P02766 1/20 0.41
▸ NFE2L2 Q16236 4/20 0.41
▸ AKR1B1 P15121 1/20 0.41
▸ KCNA5 P22460 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40
▸ SENP6 Q9GZR1 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CES2 O00748 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
SCHEMBL231071 0.98 KAT6A (0.46) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL30476135 0.98 KAT6A (0.46) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8378084 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8380966 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8376433 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8378097 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8376452 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8379692 0.95 NFE2L2 (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8379463 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1
SCHEMBL8381980 0.95 KAT6A (0.44) KAT6AMYCTSHRSMN1; SMN2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0658552-B1 Process for the preparation of alpha-tocopherol derivatives EISAI CO LTD (JP) 1999-03-31 — — EP claimed
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 claimed
CN-1108254-A Process for the preparation of alpha-tocopherol derivatives EISAI CO LTD (JP) 1995-09-13 — — CN claimed
EP-0658552-A1 Process for the preparation of alpha-tocopherol derivatives Eisai Co., Ltd. (JP) 1995-06-21 — — EP claimed
EP-1778661-B1 PROCESS FOR THE MANUFACTURE OF CHROMAN DERIVATIVES, ESPECIALLY ALPHA-TOCOPHEROL AND ALKANOATES THEREOF DSM IP ASSETS BV (NL) 2014-01-22 — — EP disclosed
US-8431727-B2 Process for the manufacture of chroman derivatives, especially α-tocopherol and alka-noates thereof DSM ASSETS B.V. (NL) 2013-04-30 — — US disclosed
CN-1968943-B Process for producing chroman derivatives, especially alpha-tocopherol and alkanoates thereof DSM IP ASSETS BV 2011-08-10 — — CN disclosed
US-20090176998-A1 Process for the manufacture of chroman derivatives, especially alpha-tocopherol and alka-noates thereof DSM ASSETS B.V. (NL) 2009-07-09 — — US disclosed
CN-1968943-A Process for producing chroman derivatives, especially alpha-tocopherol and alkanoates thereof DSM IP ASSETS BV (NL) 2007-05-23 — — CN disclosed
US-20050277777-A1 Process for the manufacture of chroman derivatives, especially alpha-tocopherol and alkanoates thereof BONRATH WERNER 2005-12-15 — — US disclosed
CN-1052978-C Process for the preparation of alpha-tocopherol derivatives EISAI CO LTD (JP) 2000-05-31 — — CN disclosed
EP-0658552-B1 Process for the preparation of alpha-tocopherol derivatives EISAI CO LTD (JP) 1999-03-31 — — EP 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
CN-1108254-A Process for the preparation of alpha-tocopherol derivatives EISAI CO LTD (JP) 1995-09-13 — — CN disclosed
EP-0658552-A1 Process for the preparation of alpha-tocopherol derivatives Eisai Co., Ltd. (JP) 1995-06-21 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050277777-A1 Process for the manufacture of chroman derivatives, especially alpha-tocopherol and alkanoates thereof TTPA, TCP1, TST KAT6A 125/4885MYC 3144/4885TSHR 186/4885
US-20090176998-A1 Process for the manufacture of chroman derivatives, especially alpha-tocopherol and alka-noates thereof TTPA, TCP1, TBL2 KAT6A 128/4885MYC 3041/4885TSHR 237/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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