SCHEMBL22628664

SCHEMBL22628664

CC(C)c1cccc(NC(=O)c2ccc(F)cc2)c1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.71
KMT2A Q03164 7/20 0.71
KCNK3 O14649 2/20 0.66
KCNK9 Q9NPC2 1/20 0.66
FADS1 O60427 1/20 0.57
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
HPGD P15428 1/20 0.55
JAK2 O60674 1/20 0.54
POLB P06746 1/20 0.54
ACKR3 P25106 1/20 0.53
MAPT P10636 1/20 0.53
SNCA P37840 1/20 0.52
PTPN1 P18031 1/20 0.51
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL23844180 0.89 RAB9A (0.62) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL5262986 0.87 NPC1 (0.60) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL21133272 0.87 FADS1 (0.58) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL8458801 0.87 RXRA (0.59) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL8283426 0.86 KCNK9 (0.69) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL9978845 0.86 FADS1 (0.64) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL30277489 0.85 MEN1 (0.71) MEN1KMT2AKCNK3KCNK9NPC1
SCHEMBL24211467 0.85 KCNK3 (0.62) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL23844177 0.84 FADS1 (0.62) MEN1KMT2AKCNK3KCNK9FADS1
SCHEMBL2358354 0.84 MEN1 (1.00) MEN1KMT2AKCNK3KCNK9NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10953668-B2 Ink jet recording ink, ink jet recording method, infrared reading method, and printed material FUJIFILM CORPORATION (JP) 2021-03-23 US disclosed
US-20200369901-A1 DISPERSION, INK JET RECORDING METHOD, RECORDED MATERIAL, AND COMPOUND FUJIFILM CORPORATION (JP) 2020-11-26 US disclosed
US-20200347252-A1 INK COMPOSITION FOR INK JET PRINTING, IMAGE FORMING METHOD, AND RECORDED MATERIAL FUJIFILM CORPORATION (JP) 2020-11-05 US disclosed