SCHEMBL22199855

SCHEMBL22199855

CNc1ccc(-c2ccc(NC(=O)c3ccc(C(C)=O)cc3)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.56
MAPT P10636 5/20 0.54
MEN1 O00255 5/20 0.54
NPSR1 Q6W5P4 2/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
HTT P42858 1/20 0.54
XBP1 P17861 1/20 0.53
LMNA P02545 3/20 0.50
POLB P06746 1/20 0.49
RXFP1 Q9HBX9 1/20 0.47
TRPV1 Q8NER1 2/20 0.46
ACP1 P24666 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.43
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 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
SCHEMBL13967728 0.94 KMT2A (0.52) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL13967727 0.91 KMT2A (0.49) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL13967731 0.85 MAPT (0.47) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL14190771 0.83 KMT2A (0.46) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL677382 0.82 MAPT (0.45) KMT2AMAPTMEN1RAB9ALMNA
SCHEMBL13645082 0.81 S1PR1 (0.47) KMT2AMAPTMEN1LMNA
SCHEMBL25143905 0.81 PTGS1 (0.66) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL16367720 0.81 PTGS1 (0.66) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL25800418 0.81 RAB9A (0.63) KMT2AMAPTMEN1NPSR1NPC1
SCHEMBL29751959 0.80 PTGS1 (0.60) KMT2AMAPTMEN1NPSR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020141713-A1 METHOD FOR PREPARING POLYAMIC ACID COMPOSITION CONTAINING NOVEL DICARBONYL COMPOUND, POLYAMIC ACID COMPOSITION, METHOD FOR MANUFACTURING POLYAMIDE-IMIDE FILM USING SAME, AND POLYAMIDE-IMIDE FILM PRODUCED BY SAME MANUFACTURING METHOD 주식회사 대림코퍼레이션 2020-07-09 WO disclosed