SCHEMBL23447441

SCHEMBL23447441

O=C(NCc1ccccc1)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.71
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
HPGD P15428 3/20 0.71
HTT P42858 3/20 0.71
RAB9A P51151 1/20 0.71
LMNA P02545 5/20 0.69
ALDH1A1 P00352 3/20 0.67
ALOX12 P18054 2/20 0.67
GAA P10253 1/20 0.67
BLM P54132 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
MTOR P42345 2/20 0.64
RXFP1 Q9HBX9 1/20 0.62
GRIK1 P39086 1/20 0.59
KDM4E B2RXH2 1/20 0.58
XBP1 P17861 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL11616056 0.88 NAMPT (0.74) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL23447438 0.87 SMN1; SMN2 (0.68) MAPTMEN1KMT2AHPGDHTT
SCHEMBL28406980 0.86 MEN1 (0.73) MAPTMEN1KMT2AHPGDHTT
SCHEMBL11620697 0.85 SMN1; SMN2 (0.77) MEN1KMT2ARAB9ALMNASMN1; SMN2
SCHEMBL28808075 0.84 MTOR (0.76) MAPTMEN1KMT2AHPGDHTT
SCHEMBL30069239 0.84 MAPT (1.00) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL17609423 0.84 MAPT (1.00) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL22289498 0.83 MAPT (1.00) MAPTMEN1KMT2AHPGDHTT
SCHEMBL14855582 0.83 MAPT (0.70) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL6348144 0.83 MYC (0.59) MAPTMEN1KMT2AHPGDHTT

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-4067340-A1 DEVELOPER AND THERMOSENSITIVE RECORDING MATERIAL Mitsubishi Chemical Corporation (JP) 2022-10-05 EP disclosed
WO-2021107037-A1 DEVELOPER AND THERMOSENSITIVE RECORDING MATERIAL 三菱ケミカル株式会社 2021-06-03 WO disclosed