SCHEMBL20876119

SCHEMBL20876119

CCOC(=O)c1nc2cc(Br)ccn2c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MAPT P10636 1/20 0.42
TARBP2 Q15633 2/20 0.41
PDE4A P27815 1/20 0.41
ELANE P08246 3/20 0.41
CYP19A1 P11511 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 1/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 3/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRG2 P18507 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
SCHEMBL21936057 0.87 MAPT (0.46) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL22519135 0.87 NPC1 (0.56) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL21936036 0.86 PTGS1 (0.44) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL31528481 0.86 RAB9A (0.52) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL24616739 0.85 PDE4A (0.47) PTGS1PTGS2NPC1RAB9ATARBP2
SCHEMBL21937178 0.82 PTGS1 (0.42) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL20876131 0.81 PTGS1 (0.41) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL20876163 0.81 PTGS1 (0.41) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL18131809 0.81 PTGS1 (0.44) PTGS1PTGS2NPC1RAB9AMAPT
SCHEMBL23387882 0.80 PTGS1 (0.65) PTGS1PTGS2RAB9APDE4AALDH1A1

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 6 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-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

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 2875/4885NPC1 4017/4885
US-10981935-B2 Heterocycle derivatives as pesticides DDT, CBR3, CBR1 PTGS1 2790/4885PTGS2 2875/4885NPC1 4017/4885

“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.