SCHEMBL6654340

SCHEMBL6654340

Cc1ccc(OCC(=O)OC(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
GAA P10253 1/20 0.58
L3MBTL1 Q9Y468 4/20 0.55
NPC1 O15118 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
MAPT P10636 3/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 1/20 0.51
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49
APH1B Q8WW43 1/20 0.49
NCSTN Q92542 1/20 0.49
APH1A Q96BI3 1/20 0.49
PSENEN Q9NZ42 1/20 0.49
WDR5 P61964 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
RAB9A P51151 1/20 0.48
PTPN1 P18031 1/20 0.48
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL14652405 0.87 MAPT (0.53) LMNAGAAL3MBTL1NPC1MAPT
SCHEMBL17652044 0.86 SMN1; SMN2 (0.64) LMNANPC1MAPTPSEN1PSEN2
SCHEMBL5515918 0.86 PSEN1 (0.49) LMNAGAAL3MBTL1NPC1TDP1
SCHEMBL4598237 0.86 PSEN1 (0.49) LMNAGAAL3MBTL1NPC1MAPT
SCHEMBL28879763 0.85 L3MBTL1 (0.49) LMNAGAAL3MBTL1NPC1TDP1
SCHEMBL16380530 0.84 L3MBTL1 (0.47) LMNAGAAL3MBTL1NPC1TDP1
SCHEMBL198467 0.84 PTPN1 (0.60) LMNAGAAL3MBTL1NPC1MAPT
SCHEMBL6608349 0.84 ALDH1A1 (0.52) GAANPC1MAPTKDM4EPSEN1
SCHEMBL6708174 0.84 PTPN1 (0.50) LMNAGAAL3MBTL1NPC1TDP1
SCHEMBL4227915 0.84 PSEN1 (0.48) LMNAGAAL3MBTL1NPC1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1209349-C Sulfonium salt and preparation method thereof KIM HO PETRO CHEMICAL CO LTD (KR) 2005-07-06 CN claimed
WO-2023009475-A1 ROCK2 INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-02-02 WO disclosed
US-9862721-B2 Tetrahydrocarboline derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2018-01-09 US disclosed
US-9353113-B2 Tetrahydrocarboline derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2016-05-31 US disclosed
US-20160031884-A1 TETRAHYDROCARBOLINE DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2016-02-04 US disclosed
US-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 US disclosed
US-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 US disclosed
US-20130045445-A1 ACTINIC-RAY- OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC-RAY- OR RADIATION-SENSITIVE RESIN FILM THEREFROM AND METHOD OF FORMING PATTERN USING THE COMPOSITION FUJIFILM CORPORATION (JP) 2013-02-21 US disclosed
CN-101061434-A Photoresist composition for deep UV and process thereof AZ ELECTRONIC MATERIALS USA (US) 2007-10-24 CN disclosed
CN-1209349-C Sulfonium salt and preparation method thereof KIM HO PETRO CHEMICAL CO LTD (KR) 2005-07-06 CN disclosed
EP-1449833-A1 BISIMIDE COMPOUND, ACID GENERATOR AND RESIST COMPOSITION EACH CONTAINING THE SAME, AND METHOD OF FORMING PATTERN FROM THE COMPOSITION Wako Pure Chemical Industries, Ltd. (JP) 2004-08-25 EP disclosed
EP-0972761-B1 Sulfonium salt and its manufacturing method KOREA KUMHO PETROCHEM CO LTD (KR) 2001-12-12 EP disclosed
US-6111143-A BY ONE-STEP REACTION BETWEEN SULFOXIDE COMPOUND AND AROMATIC COMPOUND IN PRESENCE OF PERFLUOROALKANESULFONIC ANHYDRIDE; USE AS POLYMERIZATION PHOTOINITIATOR, OR PHOTOACID GENERATOR LEAVING THE PROTECTION GROUPS OF ORGANIC COMPOUNDS KOREA KUMBO PETROCHEMICAL CO., LTD. (KR) 2000-08-29 US disclosed
CN-1243122-A Sulfonium salt and preparation method thereof KIM HO PETRO CHEMICAL CO LTD (KR) 2000-02-02 CN disclosed
EP-0972761-A1 Sulfonium salt and its manufacturing method Korea Kumho Petrochemical Co. Ltd. (KR) 2000-01-19 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-20160031884-A1 TETRAHYDROCARBOLINE DERIVATIVE ENPP2, ENPP1, ACER2 LMNA 3264/4885GAA 1190/4885L3MBTL1 3678/4885
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KRAS, NRAS, RASSF5 LMNA 4732/4885GAA 3516/4885L3MBTL1 3403/4885

“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.