SCHEMBL20876163

SCHEMBL20876163

CCOC(=O)c1nc2cc(Br)ccn2c1SCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
KDM4E B2RXH2 4/20 0.40
MAPT P10636 2/20 0.40
ELANE P08246 3/20 0.39
PDE4A P27815 1/20 0.39
TARBP2 Q15633 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.38
GABRA2 P47869 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HCRTR1 O43613 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
GABRA1 P14867 1/20 0.38

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
SCHEMBL22519208 0.88 NPC1 (0.53) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL18737696 0.87 PTGS1 (0.42) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL20887363 0.85 PTGS1 (0.34) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL21936057 0.84 MAPT (0.46) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL19711996 0.83 PTGS1 (0.42) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL31528481 0.83 RAB9A (0.52) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL21936036 0.83 PTGS1 (0.44) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL30099163 0.82 TARBP2 (0.43) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL20876119 0.81 PTGS1 (0.44) PTGS1PTGS2RAB9ANPC1KDM4E
SCHEMBL18131802 0.81 PTGS1 (0.61) PTGS1PTGS2RAB9AKDM4EMAPT

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 9 patents. 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
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-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-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 (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-20200291043-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR3, CBR1 PTGS1 2790/4885PTGS2 2875/4885RAB9A 725/4885
US-10981935-B2 Heterocycle derivatives as pesticides DDT, CBR3, CBR1 PTGS1 2790/4885PTGS2 2875/4885RAB9A 725/4885

“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.