SCHEMBL8745115

SCHEMBL8745115

CC(C)(C)c1ccc(C(=O)[O-])cc1.CC(C)(C)c1ccc(C(=O)[O-])cc1.[Cd+2]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.57
SRD5A2 P31213 1/20 0.55
MEN1 O00255 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HTT P42858 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 2/20 0.50
HIF1A Q16665 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
POLB P06746 1/20 0.50
RARB P10826 1/20 0.50
RARG P13631 1/20 0.50
SIRT1 Q96EB6 1/20 0.48
CA1 P00915 8/20 0.48
CA2 P00918 8/20 0.48
HDAC3 O15379 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47

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
SCHEMBL9316627 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL4957711 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL4961531 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
Lithium Ion SCHEMBL2778032 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL9269549 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL4959131 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL1563800 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL9120608 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
Potassium Ion SCHEMBL5888927 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL226823 0.95 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0457471-B1 Polymer stabilizer and polymer composition stabilized therewith WITCO CORP (US) 1997-01-29 EP disclosed
EP-0596020-A4 STABILIZER COMPOSITION AND POLYMER COMPOSITIONS STABILIZED THEREWITH. WITCO CORP (US) 1995-03-15 EP disclosed
EP-0406349-B1 IMPROVED STABILIZERS FOR HALOGEN-CONTAINING POLYMERS ATOCHEM NORTH AMERICA (US) 1994-12-21 EP disclosed
US-5340862-A A polyvinyl chloride blends containing a powder of alkali metal hydrogen phosphate or pyrophosphate salt; synergistic ELF ATOCHEM NORTH AMERICA, INC. (US) 1994-08-23 US disclosed
EP-0596020-A1 STABILIZER COMPOSITION AND POLYMER COMPOSITIONS STABILIZED THEREWITH WITCO CORPORATION (US) 1994-05-11 EP disclosed
US-5236981-A STABILIZED HALOGENATED POLYMER COMPOSITIONS CONTAINING A LEAD OR ORGANOTIN COMPOUND RHONE-POULENC CHIMIE (FR) 1993-08-17 US disclosed
US-5234981-A HALOGENATED POLYMER COMPOSITIONS STABILIZED WITH THE AID OF AN INORGANIC ADDITIVE RHONE-POULENC CHIMIE (FR) 1993-08-10 US disclosed
WO-1993002133-A1 STABILIZER COMPOSITION AND POLYMER COMPOSITIONS STABILIZED THEREWITH WITCO CORPORATION (US) 1993-02-04 WO disclosed
EP-0457471-A2 Polymer stabilizer and polymer composition stabilized therewith WITCO CORPORATION (US) 1991-11-21 EP disclosed
US-5034443-A Polyvinyl chloride with sodium perchlorate and calcium silicate for motor vehicle parts WITCO CORPORATION (US) 1991-07-23 US disclosed
EP-0406349-A4 IMPROVED STABILIZERS FOR HALOGEN-CONTAINING POLYMERS 1991-03-20 EP disclosed
EP-0406349-A1 IMPROVED STABILIZERS FOR HALOGEN-CONTAINING POLYMERS. M & T CHEMICALS INC (US) 1991-01-09 EP disclosed
WO-1990003999-A1 IMPROVED STABILIZERS FOR HALOGEN-CONTAINING POLYMERS M&T CHEMICALS INC. (US) 1990-04-19 WO disclosed
US-4454313-A HEAT RESISTANT PLASTICIZER DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-06-12 US disclosed
EP-0011456-B1 ORGANOTIN COMPOUNDS AND RESINS OR POLYMERS STABILIZED THEREWITH M & T CHEMICALS, INC. (US) 1983-09-07 EP disclosed
EP-0012107-B1 FLAME-RETARDANT PLASTIFIED PVC-COMPOSITION CIBA-GEIGY AG (CH) 1983-06-22 EP disclosed
US-4254017-A HEAT STABILIZER FOR POLYVINYL CHLORIDE M&T CHEMICALS INC. (US) 1981-03-03 US disclosed
EP-0012107-A1 Flame-retardant plastified PVC-composition CIBA-GEIGY AG (CH) 1980-06-11 EP disclosed
EP-0011456-A1 Organotin compounds and resins or polymers stabilized therewith M & T CHEMICALS, INC. (US) 1980-05-28 EP disclosed