SCHEMBL21609568

SCHEMBL21609568

CCSCc1[nH]c(Br)nc1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.36

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
SCHEMBL21609569 0.83 CYP1A2 (0.40)
SCHEMBL21569328 0.76 ADORA1 (0.34) HCAR2
SCHEMBL23214275 0.67 NPSR1 (0.45)
SCHEMBL3102391 0.67 PIN1 (0.33) HCAR2
SCHEMBL2522013 0.65 PIN1 (0.48) HCAR2
SCHEMBL21569304 0.61 KDM5B (0.35)
SCHEMBL18171986 0.61 HSD17B10 (0.36) HCAR2
SCHEMBL22263358 0.61 KDM4E (0.42)
SCHEMBL5727096 0.61 KDM4E (0.48)
SCHEMBL28824035 0.61 NPSR1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3814346-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2021-05-05 EP disclosed
WO-2020002082-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2020-01-02 WO disclosed