SCHEMBL16268584

SCHEMBL16268584

CCOC(=O)c1c(N)n[nH]c1-c1ccnnc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ MAPK10 P53779 1/20 0.65
▸ ALDH1A1 P00352 5/20 0.43
▸ HSD17B10 Q99714 4/20 0.43
▸ HPGD P15428 1/20 0.43
▸ PDE4D Q08499 1/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ TP53 P04637 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ CDC7 O00311 1/20 0.40
▸ DBF4 Q9UBU7 1/20 0.40
▸ MDM2 Q00987 1/20 0.39
▸ PRKCZ Q05513 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MAPT P10636 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ PKM P14618 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
SCHEMBL16268639 0.80 ALDH1A1 (0.44) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10
SCHEMBL14710459 0.80 HTT (0.75) HTTSMN1; SMN2MAPK10HSD17B10PDE4D
SCHEMBL31412612 0.73 ALPL (0.66) SMN1; SMN2ALDH1A1KMT2ATP53RAB9A
SCHEMBL600955 0.72 PDE4D (0.71) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10
SCHEMBL942577 0.72 PDE4D (0.56) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10
SCHEMBL11160154 0.70 SMN1; SMN2 (0.55) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10
SCHEMBL27489531 0.70 SMN1; SMN2 (0.55) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10
SCHEMBL6305895 0.70 CA12 (0.53) HTTSMN1; SMN2ALDH1A1HPGDKMT2A
SCHEMBL20709978 0.69 SMN1; SMN2 (0.53) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10
SCHEMBL17781303 0.69 SMN1; SMN2 (0.53) HTTSMN1; SMN2MAPK10ALDH1A1HSD17B10

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-3003042-A1 HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2016-04-13 — — EP disclosed
WO-2014191301-A1 HETEROCYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2014-12-04 — — WO disclosed
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