SCHEMBL11389233

SCHEMBL11389233

CCN(CC)C(=O)c1nc(Cl)c(Cl)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
ALPL P05186 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HRH4 Q9H3N8 1/20 0.34
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
TSHR P16473 1/20 0.33
CRHR1 P34998 1/20 0.33
TSPO P30536 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL11155938 0.79 MAP4K1 (0.35) ALDH1A1HRH4
SCHEMBL11163311 0.77 ALDH1A1 (0.36) ALDH1A1
SCHEMBL11166561 0.75 RIPK1 (0.33) ALDH1A1MAPTHPGDLMNATSHR
SCHEMBL11161716 0.74 HRH4 (0.30) HRH4
SCHEMBL11389259 0.74 HRH4 (0.33) HRH4
SCHEMBL11283559 0.72 KDM4E (0.34)
SCHEMBL11161094 0.71 ALOX15 (0.44) HPGDLMNAHRH4TSHR
SCHEMBL11162912 0.71 ADORA3 (0.37) ALDH1A1MAPTL3MBTL1HPGDLMNA
SCHEMBL11154209 0.71 PDK2 (0.31)
SCHEMBL11161713 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4268681-A HERBICIDES, PLANT GROWTH REGULATORS, INSECTICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-05-19 US disclosed
US-4234722-A HERBICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1980-11-18 US disclosed
US-4233058-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-11-11 US disclosed
US-4187100-A 4,5-Dichloro-imidazole-1-carboxylic acid aryl esters and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 1980-02-05 US disclosed
US-4187101-A 1-Acyloxymethyl-4,5-dichloro-imidazole derivatives and their use as herbicides BAYER AKTIENGESELLESCHAFT (DE) 1980-02-05 US disclosed
US-4185991-A 4,5-Dichloro-imidazole derivatives and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 1980-01-29 US disclosed
US-4183742-A HERBICIDES, INSECTICIDES, MITICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1980-01-15 US disclosed
US-4178166-A HERBICIDES, INSECTICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1979-12-11 US disclosed
US-4177055-A HERBICIDES, INSECTICIDES, MITICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1979-12-04 US disclosed