SCHEMBL7733944

SCHEMBL7733944

COC(=O)c1ccc([P+](C)(c2ccccc2)c2ccc(C(=O)OC)cc2)cc1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.51

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

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 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
MAPT P10636 4/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.45
CYP2C9 P11712 2/20 0.44
TCF4 P15884 1/20 0.44
CTNNB1 P35222 1/20 0.44
FBP1 P09467 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL9634061 1.00 TDP1 (0.51) TDP1MAPTTSHRKMT2AMEN1
SCHEMBL10484442 0.95 TDP1 (0.57) TDP1MAPTTSHRKMT2AMEN1
SCHEMBL10484459 0.90 TCF4 (0.45) TDP1MAPTTSHRKMT2AMEN1
SCHEMBL10484434 0.88 TDP1 (0.49) TDP1MAPTTSHRKMT2ACYP2C9
SCHEMBL10484503 0.87 TSHR (0.45) MAPTTSHRFBP1ALDH1A1CA12
SCHEMBL10484394 0.87 TSHR (0.45) MAPTTSHRFBP1ALDH1A1CA12
SCHEMBL11051887 0.86 TDP1 (0.48) TDP1MAPTTSHRKMT2ACYP2C9
SCHEMBL9634065 0.84 CA12 (0.41) TSHRCYP2C9FBP1ALDH1A1CA12
SCHEMBL128521 0.83 CA12 (0.44) TDP1MAPTKMT2AMEN1CYP2C9
SCHEMBL10484476 0.83 KMT2A (0.47) TDP1MAPTKMT2ACYP2C9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161128-B1 TWO-COMPONENT DRY ELECTROSTATIC DEVELOPER COMPOSITION EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-02-08 EP claimed
US-4496643-A PHOSPHONIUM, ARSONIUM, OR STIBONIUM COMPOUND IN BINDER AS TONER AND FLUOROCARBON CARRIER COATED PARTICLES EASTMAN KODAK COMPANY (US) 1985-01-29 US claimed
US-6416921-B1 FORMING NON-SPHERICAL TONER PARTICLES USING LIMITED COALESCENSE; IMPROVED TRANSFER AND CLEANING EFFICIENCY HEIDELBERG DIGITAL L.L.C. 2002-07-09 US disclosed
US-4855396-A BINDER/CHARGE AGENT IN ELECTROSTATOGRAPHIC TONER PARTICLES EASTMAN KODAK COMPANY (US) 1989-08-08 US disclosed
US-4837394-A CHARGE CONTROL AGENTS EASTMAN KODAK COMPANY (US) 1989-06-06 US disclosed
EP-0161128-B1 TWO-COMPONENT DRY ELECTROSTATIC DEVELOPER COMPOSITION EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-02-08 EP disclosed
EP-0161128-A1 Two-component dry electrostatic developer composition EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-11-13 EP disclosed
US-4496643-A PHOSPHONIUM, ARSONIUM, OR STIBONIUM COMPOUND IN BINDER AS TONER AND FLUOROCARBON CARRIER COATED PARTICLES EASTMAN KODAK COMPANY (US) 1985-01-29 US disclosed