SCHEMBL22628680

SCHEMBL22628680

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

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK9 Q9NPC2 1/20 0.69
KCNK3 O14649 1/20 0.63
HDAC3 O15379 2/20 0.62
HDAC8 Q9BY41 2/20 0.62
HDAC6 Q9UBN7 2/20 0.62
RAB9A P51151 5/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
NPC1 O15118 4/20 0.60
NR1H4 Q96RI1 3/20 0.60
MEN1 O00255 2/20 0.60
ALDH1A1 P00352 2/20 0.60
KMT2A Q03164 2/20 0.60
TP53 P04637 2/20 0.60
MAPT P10636 2/20 0.60
THRB P10828 1/20 0.60
LMNA P02545 1/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
CA1 P00915 1/20 0.60

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 0.88 RAB9A (0.62) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL8458801 0.85 RXRA (0.59) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL21133272 0.85 FADS1 (0.58) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL5262986 0.85 NPC1 (0.60) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL8283426 0.85 KCNK9 (0.69) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL9978845 0.85 FADS1 (0.64) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL22628664 0.84 MEN1 (0.71) KCNK9KCNK3RAB9ANPC1MEN1
SCHEMBL24211467 0.84 KCNK3 (0.62) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL23844177 0.83 FADS1 (0.62) KCNK9KCNK3RAB9ASMN1; SMN2NPC1
SCHEMBL22699716 0.83 TRPV1 (0.63) KCNK9KCNK3RAB9ASMN1; SMN2NPC1

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-20220017762-A1 INK JET INK FOR FORMING AN INFRARED ABSORBING IMAGE, INFRARED ABSORBING IMAGE FORMING METHOD, AND RECORDED MATERIAL FUJIFILM CORPORATION (JP) 2022-01-20 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