SCHEMBL8660800

SCHEMBL8660800

N#Cc1cccnc1Oc1c(Br)cc(NC(=S)NC(=O)c2c(F)cccc2F)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.37
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
HTT P42858 1/20 0.36
NOD2 Q9HC29 1/20 0.36
ALDH1A1 P00352 9/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
GLA P06280 2/20 0.36
NPSR1 Q6W5P4 2/20 0.35
KMT2A Q03164 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 2/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL8661611 0.91 GRM4 (0.38) GRM4JAK2JAK1TYK2HTT
SCHEMBL8662433 0.81 DHODH (0.36) ALDH1A1MAPTKMT2ASMN1; SMN2POLB
SCHEMBL9136067 0.80 NPC1 (0.36) HTTALDH1A1MAPTKDM4EKMT2A
SCHEMBL10793780 0.76 SCN9A (0.41) ALDH1A1MAPTKDM4ELMNANPSR1
SCHEMBL9134262 0.74 ALDH1A1 (0.41) HTTALDH1A1MAPTLMNAKMT2A
SCHEMBL8658782 0.72 MEN1 (0.41) ALDH1A1MAPTKDM4EKMT2APOLB
SCHEMBL8662542 0.71 ALDH1A1 (0.39) ALDH1A1MAPTKMT2ASMN1; SMN2POLB
SCHEMBL8659442 0.69 ALDH1A1 (0.48) ALDH1A1LMNASMN1; SMN2POLBMAPK1
SCHEMBL8660981 0.69 KDM4E (0.44) JAK2JAK1TYK2ALDH1A1MAPT
SCHEMBL11097980 0.67 MEN1 (0.43) JAK2JAK1TYK2ALDH1A1MAPT

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
US-5776981-A Use of acyl urea compounds for controlling endoparasites and ectoparasites of warm-blooded animals NOVARTIS CORPORATION (US) 1998-07-07 US disclosed
US-5776982-A Use of acyl urea compounds for controlling endoparasites and ectoparasites of warm-blooded animals NOVARTIS CORPORATION (US) 1998-07-07 US disclosed