SCHEMBL866631

SCHEMBL866631

CC(C)(C)OC(=O)NC1CSC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.51
CTSK P43235 2/20 0.47
GAA P10253 2/20 0.46
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
EPHX2 P34913 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
EPHX1 P07099 1/20 0.41
KDM1A O60341 2/20 0.41
MAOB P27338 1/20 0.41
CYP2C9 P11712 1/20 0.40
HSD11B1 P28845 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL12274315 0.90 BTK (0.53) BTKCTSKGAANFKB1NFKB2
SCHEMBL19510113 0.85 BTK (0.50) BTKCTSKGAANFKB1NFKB2
SCHEMBL26361659 0.85 BTK (0.50) BTKCTSKGAANFKB1NFKB2
SCHEMBL14603687 0.83 BTK (0.55) BTKCTSKGAANFKB1NFKB2
SCHEMBL3702152 0.81 BTK (0.61) BTKCTSKGAANFKB1NFKB2
SCHEMBL10343938 0.81 BTK (0.61) BTKCTSKGAANFKB1NFKB2
SCHEMBL3702157 0.81 BTK (0.61) BTKCTSKGAANFKB1NFKB2
SCHEMBL1406894 0.81 BTK (0.61) BTKCTSKGAANFKB1NFKB2
SCHEMBL927559 0.81 BTK (0.53) BTKCTSKGAANFKB1NFKB2
SCHEMBL26135662 0.79 BTK (0.51) BTKCTSKGAANFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109422739-B Deuterated indoleamine 2, 3-dioxygenase inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2022-07-12 CN disclosed
US-20200361919-A1 DEUTERATED INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION THEREOF NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2020-11-19 US disclosed
US-20200361919-A1 DEUTERATED INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION THEREOF NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2020-11-19 US disclosed
EP-3677581-A1 DEUTERATED INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION THEREOF Nanjing Transthera Biosciences Co. Ltd. (CN) 2020-07-08 EP disclosed
EP-3677581-A1 DEUTERATED INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION THEREOF Nanjing Transthera Biosciences Co. Ltd. (CN) 2020-07-08 EP disclosed
WO-2019046364-A1 INHIBITORS OF RSV REPLICATION AND APPLICATIONS THEREOF EMORY UNIVERSITY (US) 2019-03-07 WO disclosed
EP-2539335-B1 PROCESS FOR THE PREPARATION OF ISOXAZOLINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2016-12-21 EP disclosed
EP-2729458-B1 PROCESSES FOR THE PREPARATION OF THIETANAMINE SYNGENTA PARTICIPATIONS AG (CH) 2016-10-05 EP disclosed
US-9006456-B2 Processes for the preparation of thietanamine SYNGENTA PARTICIPATIONS AG (CH) 2015-04-14 US disclosed
US-20140206633-A1 PROCESS FOR THE PREPARATION OF ISOXAZOLINE DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2014-07-24 US disclosed
WO-2011104089-A1 PROCESS FOR THE PREPARATION OF ISOXAZOLINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2011-09-01 WO disclosed
EP-2213167-A1 Anthranilamide derivatives and their use for the control of insects and acari Syngenta Participations AG (CH) 2010-08-04 EP disclosed
EP-2213167-A1 Anthranilamide derivatives and their use for the control of insects and acari Syngenta Participations AG (CH) 2010-08-04 EP disclosed
US-20100168066-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-07-01 US disclosed
US-20100168066-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-07-01 US disclosed
US-20100168066-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-07-01 US disclosed
CN-101394742-A Anthranilamide derivatives and their use for the control of insects and acari SYNGENTA PARTICIPATIONS AG (CH) 2009-03-25 CN disclosed
EP-1976385-A2 ANTHRANILAMIDE DERIVATIVES AND THEIR USE FOR THE CONTROL OF INSECTS AND ACARI Syngeta Participations AG (CH) 2008-10-08 EP disclosed
WO-2007080131-A2 ANTHRANILAMIDE DERIVATIVES AND THEIR USE FOR THE CONTROL OF INSECTS AND ACARI SYNGENTA PARTICIPATIONS AG (CH) 2007-07-19 WO disclosed
WO-2007080131-A2 ANTHRANILAMIDE DERIVATIVES AND THEIR USE FOR THE CONTROL OF INSECTS AND ACARI SYNGENTA PARTICIPATIONS AG (CH) 2007-07-19 WO 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-20100168066-A1 NOVEL INSECTICIDES DDT, ACHE, CYP4F11 BTK 2449/4885CTSK 3159/4885GAA 2476/4885
US-20140206633-A1 PROCESS FOR THE PREPARATION OF ISOXAZOLINE DERIVATIVES CYP1A2, CHRM1, CYP1A1 BTK 2514/4885CTSK 3965/4885GAA 3222/4885
US-20200361919-A1 DEUTERATED INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION THEREOF IDO1, IDO2, INMT BTK 3101/4885CTSK 2647/4885GAA 1261/4885

“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.