SCHEMBL16401856

SCHEMBL16401856

FC(F)(F)Oc1ccc(-n2nnc3c4ccc(C=NNC(=S)Nc5c(Cl)cccc5Cl)cc4ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCGR P47871 3/20 0.40
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
GRK2 P25098 1/20 0.34
GAA P10253 2/20 0.33
MITF O75030 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL16401854 1.00 GCGR (0.40) GCGRNPC1RAB9AMAPTBCHE
SCHEMBL16400866 0.95 LMNA (0.40) GCGRNPC1RAB9ABCHELMNA
SCHEMBL16400868 0.95 LMNA (0.40) GCGRNPC1RAB9ABCHELMNA
SCHEMBL16400280 0.91 LMNA (0.45) GCGRRAB9AMAPTBCHEACHE
SCHEMBL16400282 0.91 LMNA (0.45) GCGRRAB9AMAPTBCHEACHE
SCHEMBL16401126 0.90 LMNA (0.38) GCGRNPC1RAB9AMAPTBCHE
SCHEMBL16401128 0.90 LMNA (0.38) GCGRNPC1RAB9AMAPTBCHE
SCHEMBL16400794 0.88 GCGR (0.39) GCGRNPC1RAB9AMAPTBCHE
SCHEMBL16400792 0.88 GCGR (0.39) GCGRNPC1RAB9AMAPTBCHE
SCHEMBL16400847 0.87 LMNA (0.43) GCGRRAB9AMAPTLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3022185-B1 PESTICIDE COMPOUNDS BASF SE (DE) 2017-09-06 EP claimed
US-9497970-B2 Pesticide compounds BASF SE (DE) 2016-11-22 US claimed
US-20160157491-A1 Pesticide Compounds BASF SE (DE) 2016-06-09 US claimed
EP-3022185-A1 PESTICIDE COMPOUNDS BASF SE (DE) 2016-05-25 EP claimed
WO-2015007682-A1 PESTICIDE COMPOUNDS BASF SE (DE) 2015-01-22 WO claimed
EP-3022185-B1 PESTICIDE COMPOUNDS BASF SE (DE) 2017-09-06 EP disclosed
US-9497970-B2 Pesticide compounds BASF SE (DE) 2016-11-22 US disclosed
US-20160157491-A1 Pesticide Compounds BASF SE (DE) 2016-06-09 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 (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-20160157491-A1 Pesticide Compounds C1R, C1S, CBR3 GCGR 1709/4885NPC1 928/4885RAB9A 197/4885

“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.