SCHEMBL14964949

SCHEMBL14964949

Cc1nonc1NC(=O)c1cc(F)c(Cl)nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48
NPC1 O15118 8/20 0.46
RAB9A P51151 7/20 0.46
RXFP1 Q9HBX9 3/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 3/20 0.43
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 2/20 0.41
TSHR P16473 2/20 0.41
CTNNB1 P35222 1/20 0.40
TCF7L2 Q9NQB0 1/20 0.40
CYP1A2 P05177 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
USP2 O75604 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL9146100 0.74 MAPT (0.39) KEAP1NFE2L2POLBKMT2AMAPT
SCHEMBL9146106 0.74 MAPT (0.39) KEAP1NFE2L2POLBKMT2AMAPT
SCHEMBL24574228 0.74 KEAP1 (0.62) KEAP1NFE2L2NPC1RAB9APOLB
SCHEMBL1457591 0.73 NPC1 (0.63) NPC1RAB9APOLBKMT2AMAPT
SCHEMBL31048876 0.72 KEAP1 (0.65) KEAP1NFE2L2NPC1RAB9APOLB
SCHEMBL22245544 0.71 NPC1 (0.46) NPC1RAB9ARXFP1POLBKMT2A
SCHEMBL12491903 0.71 NPC1 (0.50) NPC1RAB9ARXFP1POLBKMT2A
SCHEMBL14972352 0.71 RAB9A (0.53) NPC1RAB9ARXFP1POLBKMT2A
SCHEMBL20788868 0.69 KEAP1 (0.61) KEAP1NFE2L2NPC1RAB9APOLB
SCHEMBL10504210 0.69 ALDH1A1 (0.58) NPC1RAB9ARXFP1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140309115-A1 Substituted 1,2,5-oxadiazole compounds and their use as herbicides III BASF SE (DE) 2014-10-16 US disclosed
US-20140309115-A1 Substituted 1,2,5-oxadiazole compounds and their use as herbicides III BASF SE (DE) 2014-10-16 US disclosed
US-20140309115-A1 Substituted 1,2,5-oxadiazole compounds and their use as herbicides III BASF SE (DE) 2014-10-16 US disclosed
EP-2780340-A1 SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES III BASF SE (DE) 2014-09-24 EP disclosed
WO-2013072450-A1 SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES III BASF SE (DE) 2013-05-23 WO disclosed
WO-2013072450-A1 SUBSTITUTED 1,2,5-OXADIAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES III BASF SE (DE) 2013-05-23 WO 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 (1 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-20140309115-A1 Substituted 1,2,5-oxadiazole compounds and their use as herbicides III CBR3, CBR1, NOX3 KEAP1 154/4885NFE2L2 2328/4885NPC1 2919/4885

“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.