SCHEMBL7745875

SCHEMBL7745875

O=C(Nc1ccc(C(F)(F)F)c(C(F)(F)F)c1)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.76
MEN1 O00255 2/20 0.76
KMT2A Q03164 2/20 0.76
LMNA P02545 1/20 0.76
NPC1 O15118 7/20 0.66
RAB9A P51151 7/20 0.66
KCNK3 O14649 3/20 0.65
KCNK9 Q9NPC2 2/20 0.65
P2RX1 P51575 1/20 0.62
NPSR1 Q6W5P4 2/20 0.58
XBP1 P17861 1/20 0.58
EPHX1 P07099 1/20 0.58
HDAC1 Q13547 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HTT P42858 1/20 0.56
TRPV1 Q8NER1 1/20 0.56
HPGD P15428 1/20 0.55

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
SCHEMBL6054953 0.88 NPC1 (0.69) MAPTMEN1KMT2ALMNANPC1
SCHEMBL6250922 0.88 MAPT (0.72) MAPTMEN1KMT2ALMNANPC1
SCHEMBL850791 0.86 MEN1 (1.00) MAPTMEN1KMT2ALMNANPC1
SCHEMBL3531261 0.86 MAPT (0.70) MAPTMEN1KMT2ALMNANPC1
SCHEMBL6055167 0.86 LMNA (0.70) MAPTMEN1KMT2ALMNANPC1
SCHEMBL9682036 0.83 MAPT (0.65) MAPTMEN1KMT2ALMNANPC1
SCHEMBL4244853 0.83 KMT2A (0.65) MAPTMEN1KMT2ALMNANPC1
SCHEMBL5494349 0.83 MAPT (0.65) MAPTMEN1KMT2ALMNANPC1
SCHEMBL5694537 0.83 MEN1 (0.68) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL4238475 0.82 MAPT (0.64) MAPTMEN1KMT2ALMNANPC1

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
EP-1129075-A1 N-ARYL(THIO)ANTHRANILIC ACID AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VEGF RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2001-09-05 EP disclosed
WO-2000027820-A1 N-ARYL(THIO)ANTHRANILIC ACID AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VEGF RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2000-05-18 WO disclosed