SCHEMBL6569156

SCHEMBL6569156

CCCN(CCC)c1cccc(C(=O)c2ccccc2)c1N(CCC)CCC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.42
AKR1C3 P42330 2/20 0.42
ABCB1 P08183 2/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
HCAR3 P49019 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL6569228 0.92 POLB (0.44) TP53AKR1C3ABCB1GAAALDH1A1
SCHEMBL6567722 0.90 POLB (0.41) TP53AKR1C3ABCB1GAAALDH1A1
SCHEMBL6569260 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6567943 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6569145 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6567212 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6566243 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6566101 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6567783 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR
SCHEMBL6569193 0.89 CES2 (0.41) TP53GAAALDH1A1POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0939102-B1 Rubber compounds containing aromatic ketone polysulfides GOODYEAR TIRE & RUBBER (US) 2004-04-07 EP disclosed
US-6303821-B1 IMPROVE THE POLYMER-FILLER INTERACTION OF ELASTOMERS OR RUBBERS. THE GOODYEAR TIRE & RUBBER COMPANY 2001-10-16 US disclosed
US-6277926-B1 PROCESSING RUBBER BY MIXING WITH A BIS-(4-AMINOPHENYL)-CARBONYL-(1,4-PHENYLENE)-POLYSUFIDE TO INCREASE THE MOONEY VISCOSITY I.E. STIFFNESS; IMPROVED POLYMER/FILLER INTERACTION; RECEPTIVITY THE GOODYEAR TIRE & RUBBER COMPANY 2001-08-21 US disclosed
US-6075096-A BIS(ALKYLAMINO)BENZOPHENONES BRIDGED TOGETHER BY A POLYSULFIDE GROUP (SX, X=2-8) WHICH ACTS TO IMPROVE THE POLYMER-FILLER INTERACTION OF ELASTOMERS OR RUBBERS; FORMED COMPOSITE PRODUCTS SUCH AS TIRES, SHOE HEELS THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-06-13 US disclosed
EP-0939102-A2 Rubber compounds containing aromatic ketone polysulfides THE GOODYEAR TIRE & RUBBER COMPANY (US) 1999-09-01 EP disclosed