SCHEMBL16612305

SCHEMBL16612305

CN(C(=O)[O-])C(=O)N1c2ccc(N(C)C)cc2Sc2cc(N(C)C)ccc21.[Na+]

nearest known ligand 0.58

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ SNCA P37840 4/20 0.44
▸ BCHE P06276 7/20 0.43
▸ POLB P06746 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ NOX1 Q9Y5S8 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ P2RX4 Q99571 1/20 0.34
▸ CYP2D6 P10635 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ FNTA P49354 1/20 0.32
▸ FNTB P49356 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL244957 0.86 MAPK1 (0.64) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL1208061 0.82 MAPK1 (0.67) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29557693 0.82 MAPK1 (0.67) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL24860289 0.78 MAPK1 (0.65) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL22778911 0.78 MAPK1 (0.65) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29378413 0.78 MAPK1 (0.65) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL241700 0.76 KMT2A (0.53) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29387322 0.76 KMT2A (0.53) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL15007308 0.76 MAPK1 (0.53) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29387164 0.76 KMT2A (0.53) MAPK1MEN1KMT2ATDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857503-B1 METHOD FOR STABILIZING ASCORBIC ACID OXIDASE KYOWA MEDEX CO LTD (JP) 2018-01-10 — — EP disclosed
US-9546363-B2 Method for stabilizing ascorbic acid oxidase KYOWA MEDEX CO., LTD. (JP) 2017-01-17 — — US disclosed
US-20150147798-A1 METHOD FOR STABILIZING ASCORBIC ACID OXIDASE CANON MEDICAL DIAGNOSTICS CORPORATION (JP) 2015-05-28 — — US disclosed
EP-2857503-A1 METHOD FOR STABILIZING ASCORBIC ACID OXIDASE Kyowa Medex Co., Ltd. (JP) 2015-04-08 — — EP disclosed
Send feedback