SCHEMBL8356573

SCHEMBL8356573

C=C(C(=C)C(=O)NC(C(C)C)S(=O)(=O)OCCCC)C(=O)[O-].C=C(C)C(=O)OCCOC(=O)CC(C)=O.[Na+]

nearest known ligand 0.35

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 2)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 1/20 0.31
TSHR P16473 2/20 0.35

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
SCHEMBL7535348 0.82 TSHR (0.40) TSHRTHRB
SCHEMBL6276680 0.79 THRB (0.33) TSHRTHRB
SCHEMBL7025308 0.76 THRB (0.33) TSHRTHRB
SCHEMBL8587996 0.73
SCHEMBL31201416 0.68 TSHR (0.53) TSHRTHRB
SCHEMBL2221743 0.68 THRB (0.47) TSHRTHRB
SCHEMBL15263096 0.67 THRB (0.57) TSHRTHRB
SCHEMBL62134 0.67 THRB (0.57) TSHRTHRB
SCHEMBL11658746 0.66 THRB (0.55) TSHRTHRB
SCHEMBL5969505 0.66 THRB (0.55) TSHRTHRB

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
US-5989773-A FORMING A SUPER HIGH CONTRAST IMAGE USING A HYDRAZINE DERIVATIVE AND OTHER COMPOUNDS OF GIVEN FORMULA; USING A VERY STABLE DEVELOPER WHICH IS FREE OF DIHYDROXYBENZENE DEVELOPERS FUJI PHOTO FILM CO., LTD (JP) 1999-11-23 US disclosed
US-5925493-A SUPPORT WITH SILVER HALIDE EMULSIONS, DEVELOPMENT WITH HYDRAZINE AND HETEROCYCLIC CATIONIC COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1999-07-20 US disclosed