SCHEMBL6204891

SCHEMBL6204891

O=C1[N]c2cc(Nc3ccccc3)c(Cc3ccc(C(F)(F)F)cc3)cc2N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RXFP1 Q9HBX9 4/20 0.38
KIF11 P52732 3/20 0.36
P2RX3 P56373 1/20 0.36
IDH2 P48735 1/20 0.36
TAS2R14 Q9NYV8 2/20 0.35
EPHX2 P34913 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CSF1R P07333 2/20 0.35
KIT P10721 2/20 0.35
KDR P35968 2/20 0.35
ABL1 P00519 1/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL6203291 0.89 EGFR (0.39) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6204330 0.86 CNR1 (0.39) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6203101 0.86 NPC1 (0.38) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6205378 0.82 KMT2A (0.40) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6202957 0.81 ALDH1A1 (0.35) MAPTKDM4EMEN1ALDH1A1GAA
SCHEMBL6202905 0.80 LTA4H (0.41) MAPTMEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL6205452 0.80 EGFR (0.36) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6206042 0.79 CYP3A4 (0.43) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL6202823 0.79 EGFR (0.42) MAPTKDM4EMEN1ALDH1A1GAA
SCHEMBL6205611 0.78 MEN1 (0.38) MAPTKDM4EMEN1ALDH1A1KMT2A

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-1539708-A1 BENZIMIDAZOLONES AND THEIR USE AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-06-15 EP disclosed
WO-2004024699-A1 BENZIMIDAZOLONES AND THEIR USE AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-25 WO disclosed