SCHEMBL2298723

SCHEMBL2298723

O=C(Nc1ccccc1)c1c(F)c(F)c(F)c(C(=O)Nc2ccccc2)c1F

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.96
MEN1 O00255 5/20 0.83
KMT2A Q03164 5/20 0.83
TSHR P16473 3/20 0.66
MAPK1 P28482 2/20 0.66
HTT P42858 2/20 0.66
TP53 P04637 2/20 0.66
LMNA P02545 1/20 0.66
HDAC3 O15379 1/20 0.61
HDAC11 Q96DB2 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.60
ALDH1A1 P00352 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
KDM4C Q9H3R0 1/20 0.56
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52

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
SCHEMBL21551666 0.98 GAA (1.00) GAAMEN1KMT2ATSHRMAPK1
SCHEMBL29181613 0.87 GAA (0.79) GAAMEN1KMT2ATSHRMAPK1
SCHEMBL13899588 0.86 GAA (0.71) GAAMEN1KMT2ATSHRMAPK1
SCHEMBL11127480 0.83 GAA (0.72) GAAMEN1KMT2ATSHRMAPK1
SCHEMBL12189585 0.83 MEN1 (0.84) GAAMEN1KMT2ATSHRMAPK1
SCHEMBL9245480 0.80 GAA (0.69) GAAMEN1KMT2AHTTTP53
SCHEMBL13076455 0.80 GAA (0.69) GAAMEN1KMT2ATSHRMAPK1
SCHEMBL30739749 0.80 JAK2 (0.71) GAAMEN1KMT2AHTTTP53
SCHEMBL12189434 0.79 GAA (0.67) GAAMEN1KMT2AMAPK1HTT
SCHEMBL6819697 0.78 GAA (0.67) GAAMEN1KMT2ATSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110203990-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME MURPHY ANDREW PATRICK 2011-08-25 US disclosed
US-20110203990-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME MURPHY ANDREW PATRICK 2011-08-25 US disclosed
US-20110203990-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME MURPHY ANDREW PATRICK 2011-08-25 US disclosed
US-7806275-B2 Chlorine resistant polyamides and membranes made from the same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE INTERIOR, THE BUREAU OF RECLAMATION (US) 2010-10-05 US disclosed
US-7806275-B2 Chlorine resistant polyamides and membranes made from the same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE INTERIOR, THE BUREAU OF RECLAMATION (US) 2010-10-05 US disclosed
US-7806275-B2 Chlorine resistant polyamides and membranes made from the same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE INTERIOR, THE BUREAU OF RECLAMATION (US) 2010-10-05 US disclosed
WO-2008140840-A9 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME US GOV INTERIOR (US) 2009-03-12 WO disclosed
WO-2008140840-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME GOVERNMENT OF THE USA AS REPRESENTED BY THE DEPARTMENT OF THE INTERIOR - BUREAU OF RECLAMATION (US) 2008-11-20 WO disclosed
US-20080277333-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME SEPARATION SYSTEMS TECHNOLOGY INC. 2008-11-13 US disclosed
US-20080277333-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME SEPARATION SYSTEMS TECHNOLOGY INC. 2008-11-13 US disclosed
US-20080277333-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME SEPARATION SYSTEMS TECHNOLOGY INC. 2008-11-13 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-20110203990-A1 CHLORINE RESISTANT POLYAMIDES AND MEMBRANES MADE FROM THE SAME CLIC1, CLIC4, CLCN2 GAA 1998/4885MEN1 954/4885KMT2A 207/4885

“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.