SCHEMBL11301018

SCHEMBL11301018

O=C(Nc1cc(-c2cccc(Cl)c2)no1)c1c(F)cccc1F

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.59
THRB P10828 2/20 0.59
MAPK1 P28482 2/20 0.48
RORC P51449 1/20 0.48
USP30 Q70CQ3 4/20 0.48
NPY5R Q15761 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ABL1 P00519 1/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL11296616 0.88 SMN1; SMN2 (0.54) MAPTTHRBMAPK1RORCUSP30
SCHEMBL11296876 0.85 RORC (0.63) MAPTTHRBRORCSMN1; SMN2L3MBTL1
SCHEMBL11284045 0.83 IL2 (0.57) MAPTTHRBRORCUSP30SMN1; SMN2
SCHEMBL13901753 0.78 RORC (0.73) MAPTTHRBRORCSMN1; SMN2MEN1
SCHEMBL11293546 0.76 SMN1; SMN2 (0.61) MAPTTHRBRORCUSP30NPY5R
SCHEMBL11299666 0.75 USP30 (0.51) MAPTTHRBRORCUSP30SMN1; SMN2
SCHEMBL13901755 0.74 MAPT (0.79) MAPTTHRBRORCSMN1; SMN2MEN1
SCHEMBL20031383 0.74 NOTUM (0.56) MAPTMAPK1USP30NPY5RSMN1; SMN2
SCHEMBL13901756 0.72 RORC (0.73) MAPTTHRBRORCSMN1; SMN2L3MBTL1
SCHEMBL13901733 0.72 NPC1 (0.68) MAPTTHRBRORCSMN1; SMN2MEN1

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-4322429-A Isoxazolylbenzamides as insecticides ELI LILLY AND COMPANY (US) 1982-03-30 US claimed