SCHEMBL16401581

SCHEMBL16401581

Cn1nc2c(ccc3cc(/C=N/NC(=S)Nc4c(Br)cccc4Br)ccc32)c1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
HTR2A P28223 1/20 0.35
MAPT P10636 2/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
ALOX12 P18054 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GAA P10253 2/20 0.33
RAB9A P51151 2/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GRK2 P25098 1/20 0.32

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
SCHEMBL16401583 1.00 LMNA (0.35) LMNAHTTHTR2AMAPTMAOA
SCHEMBL16401076 0.92 LMNA (0.45) LMNAHTTMAPTMAOAMAOB
SCHEMBL16401077 0.92 LMNA (0.45) LMNAHTTMAPTMAOAMAOB
SCHEMBL16400273 0.91 NPC1 (0.36) LMNAHTTMAPTMAOAMAOB
SCHEMBL16400274 0.91 NPC1 (0.36) LMNAHTTMAPTMAOAMAOB
SCHEMBL16400620 0.90 LMNA (0.39) LMNAHTTMAPTMAOAMAOB
SCHEMBL16400622 0.90 LMNA (0.39) LMNAHTTMAPTMAOAMAOB
SCHEMBL16400800 0.88 LMNA (0.41) LMNAHTTMAPTMAOAMAOB
SCHEMBL16400801 0.88 LMNA (0.41) LMNAHTTMAPTMAOAMAOB
SCHEMBL19315680 0.88 MEN1 (0.36) HTR2AMAPTMAOAMAOBBCHE

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 9 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
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 1002/4885HTR2A 2883/4885

“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.