SCHEMBL4191848

SCHEMBL4191848

Nc1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2SC(F)(F)C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 6/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4C Q9H3R0 1/20 0.38
ULK1 O75385 1/20 0.36
KCNJ11 Q14654 1/20 0.36
BTK Q06187 2/20 0.36
P2RX1 P51575 2/20 0.35
HDAC1 Q13547 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 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
SCHEMBL4178309 0.94 PTGS1 (0.45) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL4181081 0.93 PTGS1 (0.47) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL13875599 0.86 KDM4E (0.46) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL4187879 0.86 MAPT (0.38) PTGS1KCNJ11P2RX1MAPTMEN1
SCHEMBL404470 0.84 PTGS1 (0.51) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL4189764 0.83 PTGS1 (0.46) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL28496399 0.83 PTGS1 (0.53) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL13875600 0.80 KDM4E (0.45) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL4182215 0.80 PTGS1 (0.47) PTGS1KDM4EALDH1A1SMN1; SMN2NPSR1
SCHEMBL4175359 0.78 MAPT (0.39) PTGS1KCNJ11P2RX1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099204-A1 Amide derivative, insecticide containing the same and method for application thereof as insecticide MITSUI CHEMICALS, INC. (JP) 2009-04-16 US disclosed
EP-1916236-A1 AMIDE DERIVATIVE, PESTICIDE CONTAINING SUCH COMPOUND AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2008-04-30 EP 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-20090099204-A1 Amide derivative, insecticide containing the same and method for application thereof as insecticide CYP2E1, GSTA1, CYP2S1 PTGS1 1316/4885KDM4E 1117/4885ALDH1A1 76/4885

“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.