SCHEMBL3182773

SCHEMBL3182773

C=C(CS(=O)(=O)c1ccccc1)C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.53
POLB P06746 3/20 0.50
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 3/20 0.48
TP53 P04637 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GLA P06280 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PSIP1 O75475 1/20 0.46
MMP2 P08253 1/20 0.45
MMP7 P09237 1/20 0.45
MMP14 P50281 1/20 0.45
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL5080063 0.84 HSD11B1 (0.58) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL28298913 0.83 HSD11B1 (0.55) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL13604251 0.81 HSD11B1 (0.41) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL28873529 0.81 HSD11B1 (0.51) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL5491920 0.80 HSD11B1 (0.56) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL194095 0.80 HSD11B1 (0.53) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL28297415 0.80 KMT2A (0.48) HSD11B1KMT2AALDH1A1L3MBTL1MAPT
SCHEMBL602 0.79 HSD11B1 (0.59) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL8959069 0.77 HSD11B1 (0.58) HSD11B1POLBKMT2AALDH1A1TP53
SCHEMBL7393019 0.76 CA12 (0.52) POLBKMT2AALDH1A1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109776324-A Homoallyltrifluoromethyl compound and preparation method thereof 南京工业大学 2019-05-21 CN claimed
CN-109776324-B Homoallyltrifluoromethyl compound and preparation method thereof 南京工业大学 2021-09-03 CN disclosed
US-20210221766-A1 METHOD FOR PRODUCING FLUORINATED COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2021-07-22 US disclosed
CN-112645895-A Isoxazoline derivative with olefin side chain and synthesis method thereof 浙江工业大学 2021-04-13 CN disclosed
EP-1666551-B1 Ink for ink jet-recording curable through irradiation and method for preparing lithographic printing plates using the same FUJIFILM CORP (JP) 2010-02-17 EP disclosed
US-7662899-B2 Organic tellurium compound, process for producing the same, living radical polymerization initiator, process for producing polymer with the same, and polymer OTSUKA CHEMICAL CO., LTD. (JP) 2010-02-16 US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-20080004366-A1 ORGANIC TELLURIUM COMPOUND, PROCESS FOR PRODUCING THE SAME, LIVING RADICAL POLYMERIZATION INITIATOR, PROCESS FOR PRODUCING POLYMER WITH THE SAME, AND POLYMER YAMAGO SHIGERU 2008-01-03 US disclosed
US-7306894-B2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJIFILM CORPORATION (JP) 2007-12-11 US disclosed
US-7306894-B2 Polymerizable composition, photopolymerizing method and process for producing lithographic printing plate using the polymerizable composition FUJIFILM CORPORATION (JP) 2007-12-11 US disclosed
US-7276569-B2 Organic tellurium compound, process for producing the same, living radical polymerization initiator, process for producing polymer with the same, and polymer OTSUKA CHEMICAL CO., LTD. (JP) 2007-10-02 US disclosed
US-20050245714-A1 Organic tellurium compound, process for producing the same, living radical polymerization initiator, process for producing polymer with the same, and polymer OTSUKA CHEMICAL CO., LTD. (JP) 2005-11-03 US disclosed
EP-1541550-A1 ORGANIC TELLURIUM COMPOUND, PROCESS FOR PRODUCING THE SAME, LIVING RADICAL POLYMERIZATION INITIATOR, PROCESS FOR PRODUCING POLYMER WITH THE SAME, AND POLYMER Otsuka Chemical Co., Ltd. (JP) 2005-06-15 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 (3 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-20050245714-A1 Organic tellurium compound, process for producing the same, living radical polymerization initiator, process for producing polymer with the same, and polymer ODC1, TERB1, TTI1 HSD11B1 2973/4885POLB 877/4885KMT2A 769/4885
US-20080004366-A1 ORGANIC TELLURIUM COMPOUND, PROCESS FOR PRODUCING THE SAME, LIVING RADICAL POLYMERIZATION INITIATOR, PROCESS FOR PRODUCING POLYMER WITH THE SAME, AND POLYMER ODC1, TERB1, TTI1 HSD11B1 2973/4885POLB 877/4885KMT2A 769/4885
US-20210221766-A1 METHOD FOR PRODUCING FLUORINATED COMPOUND AFF2, AFF1, AFF4 HSD11B1 657/4885POLB 1615/4885KMT2A 346/4885

“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.