SCHEMBL11851428

SCHEMBL11851428

CN1C(=O)C(=N)N(c2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MGLL Q99685 1/20 0.42
▸ GAA P10253 2/20 0.41
▸ GSK3A P49840 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ ELANE P08246 1/20 0.39
▸ CES2 O00748 1/20 0.39
▸ BCHE P06276 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ GRK5 P34947 1/20 0.38
▸ TYRO3 Q06418 1/20 0.38
▸ DYRK1B Q9Y463 1/20 0.38
▸ RXFP1 Q9HBX9 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
SCHEMBL11393238 0.85 MGLL (0.42) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL7080105 0.82 MGLL (0.46) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL6360785 0.78 ALDH1A1 (0.48) NPC1RAB9AALDH1A1SMN1; SMN2MGLL
SCHEMBL11395081 0.75 MGLL (0.49) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL6851073 0.73 ALDH1A1 (0.50) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL2851080 0.69 MGLL (0.56) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL5437358 0.69 OPRK1 (0.56) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL14255664 0.69 NOX4 (0.44) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL16280099 0.69 MGLL (0.62) ALDH1A1MEN1KMT2AMGLLGAA
SCHEMBL11182628 0.69 MGLL (0.62) NPC1RAB9AALDH1A1MEN1KMT2A

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
US-3992402-A OR FUNGICIDAL 5-POLYHALOETHYLIMINO- AND 5-POLYHALOVINYLIMINO-2,4-IMIDAZOLIDINEDIONES CHEVRON RESEARCH COMPANY (US) 1976-11-16 — — US disclosed
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