Michler'S Ketone

Michler'S Ketone

SCHEMBL6566205

CN(C)c1ccc(C(=O)c2ccc(N(C)C)cc2)cc1.CN(C)c1ccc(C(=O)c2ccc(N(C)C)cc2)cc1.CN(C)c1ccc(C(=O)c2ccc(N(C)C)cc2)cc1.CN(C)c1ccc(C(=O)c2ccc(N(C)C)cc2)cc1.S.S

nearest known ligand 0.95

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.95
MAPT P10636 5/20 0.95
HPGD P15428 3/20 0.95
NPC1 O15118 4/20 0.79
RAB9A P51151 3/20 0.79
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 3/20 0.55
ALOX15 P16050 2/20 0.55
HSD17B10 Q99714 1/20 0.55
MAPK1 P28482 2/20 0.54
CYP3A4 P08684 2/20 0.54
HBB P68871 1/20 0.54
POLB P06746 3/20 0.53
KDM4E B2RXH2 2/20 0.53
HDAC1 Q13547 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
LMNA P02545 4/20 0.53

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
Michler'S Ketone SCHEMBL36517 0.97 ALDH1A1 (1.00) ALDH1A1MAPTHPGDNPC1RAB9A
SCHEMBL274966 0.97 ALDH1A1 (1.00) ALDH1A1MAPTHPGDNPC1RAB9A
Michler'S Ketone SCHEMBL1396486 0.95 ALDH1A1 (0.95) ALDH1A1MAPTHPGDNPC1RAB9A
Michler'S Ketone SCHEMBL11758312 0.95 ALDH1A1 (0.95) ALDH1A1MAPTHPGDNPC1RAB9A
SCHEMBL23951924 0.91 MAPT (0.86) ALDH1A1MAPTHPGDNPC1RAB9A
SCHEMBL12757189 0.91 ALDH1A1 (0.86) ALDH1A1MAPTHPGDNPC1RAB9A
Michler'S Ketone SCHEMBL3324670 0.89 HPGD (1.00) ALDH1A1MAPTHPGDNPC1RAB9A
SCHEMBL1309237 0.89 MAPT (0.83) ALDH1A1MAPTHPGDNPC1RAB9A
SCHEMBL2263508 0.89 ALDH1A1 (0.83) ALDH1A1MAPTHPGDNPC1RAB9A
SCHEMBL43585 0.89 HPGD (1.00) ALDH1A1MAPTHPGDNPC1RAB9A

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