SCHEMBL3625129

SCHEMBL3625129

O=C(O)Cc1cc2ccccc2nc1CC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.69
ALDH1A1 P00352 3/20 0.69
KDM4E B2RXH2 3/20 0.69
MEN1 O00255 2/20 0.69
TDP1 Q9NUW8 1/20 0.47
AKR1B1 P15121 2/20 0.44
HPGD P15428 2/20 0.43
POLB P06746 1/20 0.43
THRB P10828 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.42
ACHE P22303 1/20 0.42
PRNP P04156 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
PTPRA P18433 1/20 0.41

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
SCHEMBL24597657 0.81 KDM4E (0.67) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL27712479 0.81 ALDH1A1 (0.54) KMT2AALDH1A1KDM4EMEN1AKR1B1
SCHEMBL634174 0.81 KDM4E (0.58) KMT2AALDH1A1KDM4EMEN1AKR1B1
SCHEMBL4583699 0.81 ALDH1A1 (1.00) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL30301321 0.81 ALDH1A1 (1.00) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL10509302 0.80 KDM4E (0.65) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL9727747 0.78 TDP1 (0.64) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL6602118 0.78 KDM4E (0.61) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL6602112 0.78 KDM4E (0.50) KMT2AALDH1A1KDM4EMEN1AKR1B1
SCHEMBL29131708 0.77 TDP1 (0.61) KMT2AALDH1A1KDM4EMEN1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1865049-B1 CLEANING AGENT FOR THERMOSTATIC CHAMBERS WAKO PURE CHEM IND LTD (JP) 2014-08-06 EP disclosed
US-7727949-B2 Cleaning agent for thermostatic chambers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-06-01 US disclosed
CN-100486963-C Sulfonium salt compound WAKO PURE CHEM IND LTD (JP) 2009-05-13 CN disclosed
US-20080214420-A1 Cleaning Agent for Thermostatic Chambers FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2008-09-04 US disclosed
EP-1865049-A1 CLEANING AGENT FOR THERMOSTATIC CHAMBERS Wako Pure Chemical Industries, Ltd. (JP) 2007-12-12 EP disclosed
US-6723483-B1 Sulfonium salt compounds WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-20 US disclosed
EP-1238969-A2 Sulfonium salt compounds Wako Pure Chemical Industries, Ltd. (JP) 2002-09-11 EP disclosed
CN-1302799-A Sulfonium salt compound WAKO PURE CHEM IND LTD (JP) 2001-07-11 CN disclosed
EP-1113005-A1 Sulfonium salt compounds Wako Pure Chemical Industries, Ltd. (JP) 2001-07-04 EP disclosed