SCHEMBL16401128

SCHEMBL16401128

CCc1cccc(CC)c1NC(=S)NN=Cc1ccc2c(ccc3c2nnn3-c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
GCGR P47871 2/20 0.36
GRK2 P25098 1/20 0.34
ALOX12 P18054 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
STAT3 P40763 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
SCHEMBL16401126 1.00 LMNA (0.38) LMNAHTTGCGRGRK2ALOX12
SCHEMBL16400850 0.96 LMNA (0.43) LMNAHTTGCGRGRK2ALOX12
SCHEMBL16400847 0.96 LMNA (0.43) LMNAHTTGCGRGRK2ALOX12
SCHEMBL16400282 0.91 LMNA (0.45) LMNAHTTGCGRALOX12BCHE
SCHEMBL16400280 0.91 LMNA (0.45) LMNAHTTGCGRALOX12BCHE
SCHEMBL16401006 0.90 BCHE (0.37) LMNAHTTGCGRGRK2L3MBTL1
SCHEMBL16401004 0.90 BCHE (0.37) LMNAHTTGCGRGRK2L3MBTL1
SCHEMBL16401854 0.90 GCGR (0.40) LMNAHTTGCGRGRK2BCHE
SCHEMBL16401856 0.90 GCGR (0.40) LMNAHTTGCGRGRK2BCHE
SCHEMBL16401269 0.89 LMNA (0.40) LMNAHTTGCGRGRK2ALOX12

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 LMNA 952/4885HTT 1002/4885GCGR 1709/4885

“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.