SCHEMBL22916073

SCHEMBL22916073

CNC1(C)CCCN(C(C)C)C(=O)C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL29331615 0.79 LIPE (0.33) ALDH1A1
SCHEMBL13684351 0.71 GRM5 (0.34) —
SCHEMBL22916075 0.69 — —
SCHEMBL14488660 0.68 LMNA (0.37) —
SCHEMBL18650801 0.67 PER2 (0.34) ALDH1A1
SCHEMBL29331606 0.66 LIPE (0.31) —
SCHEMBL105138 0.65 — —
SCHEMBL16503637 0.65 HSD11B1 (0.30) —
SCHEMBL1106503 0.64 CHRM2 (0.47) ALDH1A1
Ammonia Solution, Strong SCHEMBL28290304 0.64 LMNA (0.48) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021013721-A1 5-AMINO SUBSTITUTED PYRAZOLES AND TRIAZOLES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2021-01-28 — — WO disclosed
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