SCHEMBL20876176

SCHEMBL20876176

CCOC(=O)c1nc2cc(C3(C#N)CC3)ccn2c1S(=O)(=O)CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.39
AKT2 P31751 3/20 0.39
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PDE4A P27815 4/20 0.35
PDE4B Q07343 3/20 0.35
PDE4C Q08493 3/20 0.35
PDE4D Q08499 3/20 0.35
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 5/20 0.33
MAPT P10636 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 2/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL20876096 0.88 AKT1 (0.32) AKT1AKT2PDE4APDE4BPDE4C
SCHEMBL20887345 0.87 AKT1 (0.40) AKT1AKT2PTGS1PTGS2RAB9A
SCHEMBL25295098 0.85 AKT1 (0.36) AKT1AKT2PTGS1PTGS2RAB9A
SCHEMBL20876124 0.85 PDE4A (0.45) AKT1AKT2PTGS1PTGS2RAB9A
SCHEMBL20887365 0.83 PTGS1 (0.37) AKT1AKT2PTGS1PTGS2RAB9A
SCHEMBL20876145 0.82 AKT1 (0.37) AKT1AKT2PTGS1PTGS2RAB9A
SCHEMBL25245180 0.78 ALDH1A1 (0.36) PTGS2ALDH1A1KDM4EHPGD
SCHEMBL20876131 0.78 PTGS1 (0.41) PTGS1PTGS2RAB9ANPC1SMN1; SMN2
SCHEMBL20876099 0.75 PDE4A (0.33) AKT1AKT2PTGS1PTGS2PDE4A
SCHEMBL20887346 0.74 KDM4E (0.62) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE50663-E1 Heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2025-11-18 US disclosed
CN-111433215-B Derivatives of heterocyclic compounds as pest control agents 拜耳公司 2023-10-03 CN disclosed
CN-111989328-B Heterocyclic derivatives as pest control agents 拜耳公司 2023-04-18 CN disclosed
EP-3765466-B1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AG (DE) 2022-05-25 EP disclosed
US-20210169080-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-06-10 US disclosed
US-20210169080-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-06-10 US disclosed
EP-3820868-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2021-05-19 EP disclosed
US-10981935-B2 Heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-10981935-B2 Heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-20210017193-A1 CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2021-01-21 US disclosed
EP-3765466-A1 CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2021-01-20 EP disclosed
US-20200291043-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-09-17 US disclosed
US-20200291043-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-09-17 US disclosed
EP-3692045-A1 DERIVATIVES OF HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2020-08-12 EP disclosed
WO-2019201921-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-10-24 WO disclosed
WO-2019201921-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-10-24 WO disclosed
WO-2019175046-A1 CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-09-19 WO disclosed
WO-2019175046-A1 CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-09-19 WO disclosed
WO-2019068572-A1 DERIVATIVES OF HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-04-11 WO disclosed
WO-2019068572-A1 DERIVATIVES OF HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-04-11 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 (4 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-20200291043-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR3, CBR1 AKT1 704/4885AKT2 1502/4885PTGS1 2790/4885
US-20210017193-A1 CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVES AS PEST CONTROL AGENTS CCNB3, C1S, C1R AKT1 2013/4885AKT2 2177/4885PTGS1 1707/4885
US-20210169080-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, ACHE, CBR3 AKT1 839/4885AKT2 1301/4885PTGS1 2433/4885
US-10981935-B2 Heterocycle derivatives as pesticides DDT, CBR3, CBR1 AKT1 704/4885AKT2 1502/4885PTGS1 2790/4885

“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.