SCHEMBL19844752

SCHEMBL19844752

Fc1cccc(-c2noc(-c3cccs3)n2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 13/20 0.66
RAB9A P51151 13/20 0.66
SMN1; SMN2 Q16637 8/20 0.66
TP53 P04637 5/20 0.66
MAPK1 P28482 4/20 0.66
NFKB1 P19838 2/20 0.66
NFKB2 Q00653 2/20 0.66
RELA Q04206 2/20 0.66
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
HSD17B10 Q99714 1/20 0.66
MAPT P10636 3/20 0.63
NPSR1 Q6W5P4 1/20 0.62
ALDH1A1 P00352 5/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
LMNA P02545 1/20 0.59
ATM Q13315 1/20 0.59
MAOA P21397 1/20 0.59
MAOB P27338 1/20 0.59
CA12 O43570 1/20 0.53

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
SCHEMBL3262521 0.84 NPC1 (0.78) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL13171433 0.83 RAB9A (0.72) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL19844750 0.83 NPC1 (0.66) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL13930836 0.83 NPC1 (0.66) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL13930792 0.82 CASP3 (0.65) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL2459287 0.82 NPC1 (0.79) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL59658 0.80 NPC1 (0.62) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL4255046 0.79 NPC1 (0.58) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL3263301 0.79 NPC1 (0.60) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL3263395 0.77 NPC1 (0.57) NPC1RAB9ASMN1; SMN2TP53MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035793-B2 Method for producing 1,2,4-oxadiazole derivative ASAHI GLASS COMPANY, LIMITED (JP) 2018-07-31 US disclosed
US-10035793-B2 Method for producing 1,2,4-oxadiazole derivative ASAHI GLASS COMPANY, LIMITED (JP) 2018-07-31 US disclosed
US-20180037578-A1 METHOD FOR PRODUCING 1,2,4-OXADIAZOLE DERIVATIVE ASAHI GLASS COMPANY, LIMITED (JP) 2018-02-08 US disclosed
US-20180037578-A1 METHOD FOR PRODUCING 1,2,4-OXADIAZOLE DERIVATIVE ASAHI GLASS COMPANY, LIMITED (JP) 2018-02-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10035793-B2 Method for producing 1,2,4-oxadiazole derivative CBR3, CBR1, HSD3B1 NPC1 1591/4885RAB9A 3787/4885SMN1; SMN2 4774/4885
US-20180037578-A1 METHOD FOR PRODUCING 1,2,4-OXADIAZOLE DERIVATIVE CBR3, CBR1, HSD3B1 NPC1 1591/4885RAB9A 3787/4885SMN1; SMN2 4774/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.