SCHEMBL28706355

SCHEMBL28706355

C=CCN(CC(=O)NC(=O)C=C)C(=O)C(Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
DPP4 P27487 1/20 0.30

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
SCHEMBL17394544 0.81 TSHR (0.39) ALDH1A1DPP4
SCHEMBL166343 0.79 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2DPP4
Dichlormid SCHEMBL117463 0.77 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4
Dichlormid SCHEMBL20564640 0.77 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2DPP4
SCHEMBL22444562 0.77 ALDH1A1 (0.33) ALDH1A1DPP4
SCHEMBL17394545 0.76 MCL1 (0.33) ALDH1A1DPP4
SCHEMBL11743584 0.75 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2DPP4
SCHEMBL11153055 0.75 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2DPP4
SCHEMBL11744785 0.75 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2DPP4
SCHEMBL10559103 0.72 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2DPP4

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
CN-110914264-B Heterocyclic compound and harmful arthropod control agent containing same 住友化学株式会社 2022-02-11 CN disclosed