SCHEMBL27300366

SCHEMBL27300366

NCc1ccc(Oc2cc(F)ccc2F)nc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HSPB1 P04792 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.39
KDM4E B2RXH2 1/20 0.39
P2RX3 P56373 3/20 0.38
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
MAOB P27338 4/20 0.37
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAP4K4 O95819 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
ELOVL1 Q9BW60 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
SCHEMBL27295445 0.88 HSPB1 (0.56) MEN1KMT2AHSPB1LOXL2KDM4E
Hydrochloric Acid SCHEMBL31473407 0.87 HSPB1 (0.54) MEN1KMT2AHSPB1LOXL2KDM4E
SCHEMBL27295185 0.85 KMT2A (0.65) MEN1KMT2AHSPB1LOXL2KDM4E
Hydrochloric Acid SCHEMBL31473356 0.84 KMT2A (0.63) MEN1KMT2AHSPB1LOXL2KDM4E
SCHEMBL16792569 0.80 MEN1 (0.71) MEN1KMT2AHSPB1KDM4EALOX5AP
SCHEMBL23380132 0.80 L3MBTL1 (0.44) MEN1KMT2AHSPB1P2RX3L3MBTL1
SCHEMBL27299735 0.79 KMT2A (0.50) MEN1KMT2AHSPB1LOXL2KDM4E
SCHEMBL27300453 0.79 MEN1 (0.37) MEN1KMT2AHSPB1LOXL2KDM4E
SCHEMBL30744447 0.78 MEN1 (0.63) MEN1KMT2AHSPB1LOXL2KDM4E
SCHEMBL4380974 0.78 MEN1 (0.63) MEN1KMT2AHSPB1LOXL2KDM4E

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-2024029489-A1 KIT INHIBITORS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF MODULUS DISCOVERY, INC. (JP) 2024-02-08 WO disclosed