SCHEMBL791385

SCHEMBL791385

O=C(Nc1cccnc1)c1ccc(C(F)(F)F)s1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.60
LMNA P02545 3/20 0.57
PTBP1 P26599 1/20 0.57
HTT P42858 1/20 0.57
KLF5 Q13887 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
EPHX2 P34913 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
HIF1A Q16665 1/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
NAMPT P43490 2/20 0.51
CYP11B1 P15538 4/20 0.51
CYP11B2 P19099 4/20 0.51
TSHR P16473 1/20 0.48
TRPV1 Q8NER1 1/20 0.48

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
SCHEMBL12529291 0.86 L3MBTL1 (0.60) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL28132033 0.85 L3MBTL1 (0.72) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL2202547 0.84 L3MBTL1 (0.60) L3MBTL1LMNAPTBP1HTTKLF5
Trifluoroacetic Acid SCHEMBL2204433 0.81 L3MBTL1 (0.56) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL20764120 0.80 EPHX2 (0.59) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL6678035 0.79 LMNA (0.65) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL1588043 0.79 L3MBTL1 (0.64) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL14625554 0.79 L3MBTL1 (0.64) L3MBTL1LMNAPTBP1HTTKLF5
SCHEMBL20764082 0.78 MEN1 (0.58) L3MBTL1SMN1; SMN2EPHX2NPC1RAB9A
SCHEMBL12529828 0.78 NPC1 (0.62) L3MBTL1LMNAPTBP1HTTKLF5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616459-A1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS I BASF SE (DE) 2013-07-24 EP claimed
WO-2012034961-A1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS I BASF SE (DE) 2012-03-22 WO claimed
EP-2616459-B1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS I BASF SE (DE) 2016-05-04 EP disclosed
US-8609700-B2 Pyridine compounds for controlling invertebrate pests I BASF SE (DE) 2013-12-17 US disclosed
EP-2616459-A1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS I BASF SE (DE) 2013-07-24 EP disclosed
US-20130178502-A1 Pyridine Compounds for Controlling Invertebrate Pests I BASF SE (DE) 2013-07-11 US disclosed
WO-2012034961-A1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS I BASF SE (DE) 2012-03-22 WO 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-20130178502-A1 Pyridine Compounds for Controlling Invertebrate Pests I GRIN2A, PRXL2A, MT-CO2 L3MBTL1 3173/4885LMNA 2955/4885PTBP1 2923/4885

“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.