SCHEMBL3464853

SCHEMBL3464853

FC(F)(F)c1cc(-c2ccco2)[nH]n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.58
MAPT P10636 8/20 0.53
KMT2A Q03164 6/20 0.53
MEN1 O00255 5/20 0.53
POLB P06746 4/20 0.53
HPGD P15428 8/20 0.49
KDM4E B2RXH2 8/20 0.49
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
ALOX15 P16050 2/20 0.49
HTT P42858 4/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GFER P55789 1/20 0.45
ALOX12 P18054 1/20 0.45
HSD17B10 Q99714 5/20 0.43
NPC1 O15118 2/20 0.43
TP53 P04637 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.43
NFKB1 P19838 1/20 0.43

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
SCHEMBL1940621 0.86 KDM4E (0.47) PDPK1MAPTKMT2AMEN1POLB
SCHEMBL14008960 0.83 PDPK1 (0.58) PDPK1MAPTKMT2AMEN1POLB
SCHEMBL13483394 0.81 PDPK1 (0.55) PDPK1MAPTKMT2AMEN1POLB
Hydrochloric Acid SCHEMBL3499651 0.77 PDPK1 (0.55) PDPK1MAPTKMT2AMEN1POLB
Isoquinoline SCHEMBL29245878 0.76 MAPT (0.43) PDPK1MAPTKMT2AMEN1POLB
SCHEMBL15375205 0.75 CA2 (0.33)
Isobutane SCHEMBL28537865 0.74 MEN1 (0.42) PDPK1MAPTKMT2AMEN1POLB
SCHEMBL2736625 0.74 PDPK1 (0.64) PDPK1MAPTKMT2AMEN1POLB
SCHEMBL570420 0.74 PDPK1 (1.00) PDPK1MAPTKMT2AMEN1POLB
SCHEMBL26905260 0.74 PDPK1 (0.64) PDPK1MAPTKMT2AMEN1POLB

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024133426-A1 METHOD FOR CONTROLLING DIAMIDE RESISTANT PESTS AND COMPOUNDS THEREFOR SYNGENTA CROP PROTECTION AG (CH) 2024-06-27 WO disclosed
WO-2024133426-A1 METHOD FOR CONTROLLING DIAMIDE RESISTANT PESTS AND COMPOUNDS THEREFOR SYNGENTA CROP PROTECTION AG (CH) 2024-06-27 WO disclosed
US-8338437-B2 Methyl transferase inhibitors; antiproliferative agents; antiinflammatory agents; immunotherapy; infection therapy METHYLGENE INC. (CA) 2012-12-25 US disclosed
US-8338437-B2 Methyl transferase inhibitors; antiproliferative agents; antiinflammatory agents; immunotherapy; infection therapy METHYLGENE INC. (CA) 2012-12-25 US disclosed
US-8338437-B2 Methyl transferase inhibitors; antiproliferative agents; antiinflammatory agents; immunotherapy; infection therapy METHYLGENE INC. (CA) 2012-12-25 US disclosed
US-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 US disclosed
US-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 US disclosed
US-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 US disclosed
US-20100240618-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2010-09-23 US disclosed
US-20100240618-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2010-09-23 US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 US disclosed
EP-1691810-A4 SUBSTITUTED PIPERAZINES CHEMOCENTRYX INC (US) 2009-07-01 EP disclosed
US-20080280925-A1 Amines as Small Molecule Inhibitors METHYLGENE INC. 2008-11-13 US disclosed
US-20080280925-A1 Amines as Small Molecule Inhibitors METHYLGENE INC. 2008-11-13 US disclosed
US-20080280925-A1 Amines as Small Molecule Inhibitors METHYLGENE INC. 2008-11-13 US disclosed
EP-1691810-A1 SUBSTITUTED PIPERAZINES ChemoCentryx Inc (US) 2006-08-23 EP disclosed
US-20060106218-A1 Substituted piperazines CHEMOCENTRYX, INC. (US) 2006-05-18 US disclosed
US-20050256130-A1 Substituted piperazines CHEMOCENTRYX, INC. (US) 2005-11-17 US disclosed
WO-2005056015-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2005-06-23 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 (4 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-20080280925-A1 Amines as Small Molecule Inhibitors CARM1, PRMT1, PRMT3 PDPK1 2538/4885MAPT 71/4885KMT2A 186/4885
US-20060106218-A1 Substituted piperazines CCR1, CCR3, CCRL2 PDPK1 2092/4885MAPT 4063/4885KMT2A 3775/4885
US-20050256130-A1 Substituted piperazines CCR1, CCR3, CCRL2 PDPK1 2092/4885MAPT 4063/4885KMT2A 3775/4885
US-20100240618-A1 SUBSTITUTED PIPERAZINES CCR1, CCR3, CCRL2 PDPK1 2092/4885MAPT 4063/4885KMT2A 3775/4885

“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.