SCHEMBL3369009

SCHEMBL3369009

CCCCNC(C)(C)CC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.41
TSHR P16473 5/20 0.39
ALDH1A1 P00352 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH7 P40394 1/20 0.35
CA12 O43570 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.31
THRB P10828 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL3370320 0.92 EPHX1 (0.48) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL3373268 0.90 EPHX1 (0.52) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL37597 0.90 EPHX1 (0.52) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL7110706 0.90 EPHX1 (0.52) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL3369909 0.90 EPHX1 (0.52) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL10589508 0.90 EPHX1 (0.52) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL37783 0.90 EPHX1 (0.52) EPHX1TSHRALDH1A1ADH1BADH1C
SCHEMBL19679395 0.88 EPHX1 (0.34) EPHX1TSHRTDP1
SCHEMBL27577156 0.88 EPHX1 (0.39) EPHX1TSHRALDH1A1TDP1
Hydrochloric Acid SCHEMBL8041489 0.87 EPHX1 (0.50) EPHX1TSHRALDH1A1ADH1BADH1C

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 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10865163-B2 Carbon dioxide as a directing group for C—H functionalization reactions involving Lewis basic amines, alcohols, thiols, and phosphines for the synthesis of compounds THE UNIVERSITY OF TOLEDO (US) 2020-12-15 US claimed
US-20190185392-A1 Carbon Dioxide as a Directing Group for C-H Functionalization Reactions Involving Lewis Basic Amines, Alcohols, Thiols, and Phosphines for the Synthesis of Compounds THE UNIVERSITY OF TOLEDO (US) 2019-06-20 US claimed
CN-116769408-A Pressure-sensitive adhesive sheet 日东电工(上海松江)有限公司 2023-09-19 CN disclosed
CN-116769409-A Pressure-sensitive adhesive sheet 日东电工(上海松江)有限公司 2023-09-19 CN disclosed
CN-113382859-B Surface protective film 日东电工株式会社 2023-08-11 CN disclosed
CN-116034147-A Adhesive composition containing antistatic agent and surface protective film 株式会社LG化学 2023-04-28 CN disclosed
CN-115097551-A Optical member with surface protective film 日东电工株式会社 2022-09-23 CN disclosed
CN-114907787-A Adhesive sheet and optical member 日东电工株式会社 2022-08-16 CN disclosed
CN-114716944-A Surface protective film 日东电工株式会社 2022-07-08 CN disclosed
CN-114605931-A Surface protective film 日东电工株式会社 2022-06-10 CN disclosed
CN-110476003-B Heat insulation base plate 日东电工株式会社 2022-04-22 CN disclosed
CN-1667071-A Adhesive composition, adhesive sheets and surface protective film NITTO DENKO CORP (JP) 2005-09-14 CN disclosed
EP-0994108-B1 PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-05-14 EP disclosed
CN-1084739-C Process for producing 2-hydroxybenzamide derivatives ZERIA PHARMACEUTICAL CO.,LTD. (JP) 2002-05-15 CN disclosed
EP-0838508-B1 Aqueous ink composition for use in an ink-jet printer SEIKO EPSON CORP (JP) 2001-08-29 EP disclosed
US-6197970-B1 REACTING WITH SECONDARY OR TERTIARY AMINE; DEBLOCKING, DEPROTECTING ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
CN-1261357-A Process for preparing 2-hydroxybenzamide derivatives ZERIA PHARM CO LTD (JP) 2000-07-26 CN disclosed
EP-0994108-A1 PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP disclosed
US-5871572-A COLORANT, WATER, A WATER-SOLUBLE ORGANIC SOLVENT, AND PECTIC ACID SEIKO EPSON CORPORATION (JP) 1999-02-16 US disclosed
EP-0838508-A2 Aqueous ink composition for use in an ink-jet printer SEIKO EPSON CORPORATION (JP) 1998-04-29 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-20190185392-A1 Carbon Dioxide as a Directing Group for C-H Functionalization Reactions Involving Lewis Basic Amines, Alcohols, Thiols, and Phosphines for the Synthesis of Compounds CHKB, HRH3, PNMT EPHX1 1492/4885TSHR 1440/4885ALDH1A1 1501/4885
US-10865163-B2 Carbon dioxide as a directing group for C—H functionalization reactions involving Lewis basic amines, alcohols, thiols, and phosphines for the synthesis of compounds CHKB, HRH3, PNMT EPHX1 1556/4885TSHR 1464/4885ALDH1A1 1388/4885

“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.