SCHEMBL11524682

SCHEMBL11524682

O=C(NC(=O)c1c(Cl)cccc1Cl)Nc1cnc(S(=O)(=O)c2ccccc2C(F)(F)F)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.41
RORC P51449 2/20 0.40
NPC1 O15118 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
NAMPT P43490 4/20 0.39
RAB9A P51151 2/20 0.38
RPS6KA3 P51812 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALKBH2 Q6NS38 1/20 0.37
ALKBH3 Q96Q83 1/20 0.37
FTO Q9C0B1 1/20 0.37
SLC22A12 Q96S37 1/20 0.36
GRM4 Q14833 1/20 0.36
P2RX7 Q99572 1/20 0.36

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
SCHEMBL11522493 0.80 RAB9A (0.44) RORCNPC1KDM4EALDH1A1MAPK1
SCHEMBL11521954 0.79 TYK2 (0.44) TYK2RORCNPC1KDM4EALDH1A1
SCHEMBL11523665 0.78 HCRTR1 (0.48) TYK2RORCNPC1KDM4EALDH1A1
SCHEMBL11522756 0.78 KDM4E (0.48) TYK2RORCNPC1KDM4EALDH1A1
SCHEMBL11524635 0.76 TYK2 (0.43) TYK2RORCNPC1KDM4EALDH1A1
SCHEMBL8657584 0.76 RAB9A (0.57) NPC1RAB9ARPS6KA3MEN1MAPT
SCHEMBL11519411 0.74 RAB9A (0.47) TYK2NPC1KDM4ERAB9AMAPT
SCHEMBL11526152 0.74 RAB9A (0.42) TYK2NPC1KDM4EALDH1A1MAPK1
SCHEMBL11524573 0.72 RAB9A (0.46) TYK2NPC1RAB9AMEN1MAPT
SCHEMBL11522976 0.72 RAB9A (0.45) TYK2NPC1KDM4ERAB9AMAPT

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-4160834-A INSECTICIDES ELI LILLY AND COMPANY (US) 1979-07-10 US disclosed
US-4083977-A Novel insecticidal 1-(substituted benzoyl)-3-(substituted pyrazinyl)ureas ELI LILLY AND COMPANY (US) 1978-04-11 US disclosed