SCHEMBL16401576

SCHEMBL16401576

Cc1cccc(C)c1NC(=S)NN=Cc1ccc2c(c1)CCc1c-2noc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
ALOX12 P18054 1/20 0.41
S1PR1 P21453 3/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMURF2 Q9HAU4 2/20 0.36
SMURF1 Q9HCE7 2/20 0.36
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL16401572 1.00 LMNA (0.44) LMNAHTTALOX12S1PR1GAA
SCHEMBL16401312 0.94 LMNA (0.44) LMNAHTTALOX12GAAMAPK1
SCHEMBL16401314 0.94 LMNA (0.44) LMNAHTTALOX12GAAMAPK1
SCHEMBL16400287 0.93 S1PR1 (0.36) LMNAHTTALOX12S1PR1GAA
SCHEMBL16400286 0.93 S1PR1 (0.36) LMNAHTTALOX12S1PR1GAA
SCHEMBL16401268 0.91 S1PR1 (0.37) LMNAHTTS1PR1RAB9AMEN1
SCHEMBL16401270 0.91 S1PR1 (0.37) LMNAHTTS1PR1RAB9AMEN1
SCHEMBL17813872 0.90 TP53 (0.40) LMNAHTTALOX12GAAMAPK1
SCHEMBL16401020 0.88 ALOX12 (0.44) LMNAHTTALOX12S1PR1GAA
SCHEMBL16401021 0.88 ALOX12 (0.44) LMNAHTTALOX12S1PR1GAA

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 1002/4885ALOX12 3173/4885

“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.