SCHEMBL8840201

SCHEMBL8840201

O=C(NC(=O)c1ccccc1F)Nc1cc(Cl)c(Br)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.50
RAB9A P51151 5/20 0.50
HPGD P15428 3/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
TP53 P04637 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
ALDH1A1 P00352 2/20 0.48
GAA P10253 1/20 0.46
PNLIP P16233 1/20 0.46
GRM4 Q14833 1/20 0.46
PYGL P06737 3/20 0.46
LMNA P02545 1/20 0.46
PPIA P62937 1/20 0.46
GCGR P47871 1/20 0.46

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
SCHEMBL8840336 0.89 NPC1 (0.52) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8840355 0.89 NPC1 (0.52) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8840269 0.88 TRPV1 (0.52) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8840275 0.87 POLB (0.57) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8840257 0.85 MEN1 (0.59) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL8840308 0.83 TLR7 (0.54) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL11133448 0.81 STK39 (0.55) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8656267 0.80 PNLIP (0.52) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL11359908 0.79 NPC1 (0.66) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8658796 0.79 PNLIP (0.62) NPC1RAB9AHPGDMAPTSMN1; SMN2

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-5607977-A PESTICIDES SHELL AGRAR GMBH & CO. KG (DE) 1997-03-04 US disclosed