SCHEMBL7137151

SCHEMBL7137151

CC(=O)Nc1ccc(F)c([Ti])c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
POLB P06746 2/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
RXFP1 Q9HBX9 2/20 0.39
PKM P14618 1/20 0.38
EPHX2 P34913 2/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC2 Q92769 1/20 0.37

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
SCHEMBL2564600 0.82 ALDH1A1 (0.56) HDAC1HDAC6CA1CA2CA9
SCHEMBL7143473 0.81 HTT (0.57) KDM4EALDH1A1SMN1; SMN2
SCHEMBL27508225 0.81 L3MBTL1 (0.44) CA1CA2CA9POLBMAPT
SCHEMBL10982177 0.79 HDAC1 (0.47) HDAC1HDAC6CA1CA2CA9
SCHEMBL20051716 0.79 CA1 (0.50) HDAC1HDAC6CA1CA2CA9
SCHEMBL6850023 0.79 ALDH1A1 (0.38) CA1CA2CA9MAPTALDH1A1
SCHEMBL7144364 0.78 MAPK1 (0.47) POLBKDM4EALDH1A1PKMEPHX2
SCHEMBL24692785 0.78 HDAC1 (0.50) HDAC1HDAC6CA1CA2CA9
Hydrochloric Acid SCHEMBL29241446 0.78 CA1 (0.49) HDAC1HDAC6CA1CA2CA9
Hydrochloric Acid SCHEMBL30961647 0.78 CA1 (0.49) HDAC1HDAC6CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1215379-C Original edition for lithographic printing plate FUJI PHOTO FILM CO LTD (JP) 2005-08-17 CN disclosed
CN-1171122-C Optical polymerism composition 富士胶片株式会社 2004-10-13 CN disclosed
US-20030190554-A1 Photopolymerization; development using alkalinity developer FUJIFILM CORPORATION (JP) 2003-10-09 US disclosed
CN-1425068-A Fungal transcriptional activator useful in methods of producing polypeptides NOVOZYMES AS (DK) 2003-06-18 CN disclosed
CN-1374559-A Original edition for lithographic printing plate FUJI PHOTO FILM CO LTD (JP) 2002-10-16 CN disclosed
CN-1319784-A Optical polymerism composition FUJI PHOTO FILM CO LTD (JP) 2001-10-31 CN disclosed