SCHEMBL8658474

SCHEMBL8658474

CC(=O)ON1Cc2ccccc2C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 4/20 0.45
ALOX15 P16050 4/20 0.45
TSHR P16473 2/20 0.45
SIRT1 Q96EB6 1/20 0.45
NPC1 O15118 5/20 0.45
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
PKM P14618 3/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.44
XIAP P98170 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 2/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL29676976 1.00 KMT2A (0.50) KMT2AKDM4EALOX15TSHRSIRT1
SCHEMBL8523119 0.84 BCAT2 (0.46) KMT2AKDM4EALOX15TSHRPKM
SCHEMBL29918241 0.84 BCAT2 (0.46) KMT2AKDM4EALOX15TSHRPKM
SCHEMBL11346171 0.83 KMT2A (0.50) KMT2AKDM4EALOX15TSHRSIRT1
SCHEMBL24629272 0.83 KMT2A (0.46) KMT2AKDM4EALOX15TSHRSIRT1
SCHEMBL13479783 0.81 KMT2A (0.47) KMT2AKDM4EALOX15TSHRSIRT1
SCHEMBL29035381 0.79 MAOA (0.40) KDM4EALDH1A1HSD17B10TDP1L3MBTL1
SCHEMBL148804 0.79 KMT2A (0.57) KMT2AKDM4EALOX15TSHRSIRT1
SCHEMBL29450202 0.79 KMT2A (0.57) KMT2AKDM4EALOX15TSHRSIRT1
Hydrochloric Acid SCHEMBL31097467 0.77 KMT2A (0.55) KMT2AKDM4EALOX15TSHRSIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3814351-A1 COMPOUNDS F. Hoffmann-La Roche AG (CH) 2021-05-05 EP disclosed
EP-1666551-B1 Ink for ink jet-recording curable through irradiation and method for preparing lithographic printing plates using the same FUJIFILM CORP (JP) 2010-02-17 EP disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 US disclosed
CN-1835934-A oxazole derivatives as cyclooxygenase inhibitors ASTELLAS PHARMA INC (JP) 2006-09-20 CN disclosed
EP-0409617-B1 Process for the preparation of metal complexes of thiolactams ZENECA LTD (GB) 1998-11-11 EP disclosed
US-5506253-A REACTING ACETOXYPYRROLIDINONE COMPOUND WITH METAL TRIALKYLSILANOLATE ZENECA LIMITED (GB) 1996-04-09 US disclosed
US-5393750-A Biocides ZENECA, LIMITED (GB) 1995-02-28 US disclosed
US-5120856-A Bactericides, fungicides, algicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-06-09 US disclosed
EP-0409617-A2 Thiolactams, process for their preparation and use as biocides ZENECA LIMITED (GB) 1991-01-23 EP disclosed